N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide

C168H336N24O14 — CID 159464538

IUPACN-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide
SMILESCCCCCCCCCC(=O)C(CCCN)NC(=O)CCCCCCC.CCCCCCCCCC(=O)C(CCCN=C(N)N)NC(=O)CCCCCCC.CCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)CCC.CCCCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)CCCCCCCCC.CCCCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)CCCCCCCCCCC.CCCCCCCCCCCCC(=O)C(CCCN)NC(=O)CCCCCCC.CCCCCCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)CCC
InChIInChI=1S/C29H58N4O2.C27H54N4O2.C25H50N2O2.2C23H46N4O2.C22H44N2O2.C19H38N4O2/c1-3-5-7-9-11-13-15-17-19-23-27(34)26(22-21-25-32-29(30)31)33-28(35)24-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-12-14-16-18-22-26(33)31-24(20-19-23-30-27(28)29)25(32)21-17-15-13-10-8-6-4-2;1-3-5-7-9-10-11-12-13-15-16-20-24(28)23(19-18-22-26)27-25(29)21-17-14-8-6-4-2;1-3-5-6-7-8-9-10-11-12-13-14-18-22(29)27-20(21(28)16-4-2)17-15-19-26-23(24)25;1-3-5-7-9-10-12-13-17-21(28)20(16-15-19-26-23(24)25)27-22(29)18-14-11-8-6-4-2;1-3-5-7-9-10-12-13-17-21(25)20(16-15-19-23)24-22(26)18-14-11-8-6-4-2;1-3-5-6-7-8-9-10-14-18(25)23-16(17(24)12-4-2)13-11-15-22-19(20)21/h26H,3-25H2,1-2H3,(H,33,35)(H4,30,31,32);24H,3-23H2,1-2H3,(H,31,33)(H4,28,29,30);23H,3-22,26H2,1-2H3,(H,27,29);2*20H,3-19H2,1-2H3,(H,27,29)(H4,24,25,26);20H,3-19,23H2,1-2H3,(H,24,26);16H,3-15H2,1-2H3,(H,23,25)(H4,20,21,22)
InChIKeyLUZXJUKTUKKPQQ-UHFFFAOYSA-N
MW2916.69 g/mol
LogP37.05
Rot. Bonds147

About N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide

N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide (PubChem CID 159464538) has the molecular formula C168H336N24O14 and a molecular weight of 2916.69 g/mol. Its IUPAC name is N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide.

Molecular Properties

Compound NameN-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide
PubChem CID159464538
Molecular FormulaC168H336N24O14
Molecular Weight2916.69 g/mol
Exact Mass2914.63
IUPAC NameN-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide
SMILESCCCCCCCCCC(=O)C(CCCN)NC(=O)CCCCCCC.CCCCCCCCCC(=O)C(CCCN=C(N)N)NC(=O)CCCCCCC.CCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)CCC.CCCCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)CCCCCCCCC.CCCCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)CCCCCCCCCCC.CCCCCCCCCCCCC(=O)C(CCCN)NC(=O)CCCCCCC.CCCCCCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)CCC
InChIInChI=1S/C29H58N4O2.C27H54N4O2.C25H50N2O2.2C23H46N4O2.C22H44N2O2.C19H38N4O2/c1-3-5-7-9-11-13-15-17-19-23-27(34)26(22-21-25-32-29(30)31)33-28(35)24-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-12-14-16-18-22-26(33)31-24(20-19-23-30-27(28)29)25(32)21-17-15-13-10-8-6-4-2;1-3-5-7-9-10-11-12-13-15-16-20-24(28)23(19-18-22-26)27-25(29)21-17-14-8-6-4-2;1-3-5-6-7-8-9-10-11-12-13-14-18-22(29)27-20(21(28)16-4-2)17-15-19-26-23(24)25;1-3-5-7-9-10-12-13-17-21(28)20(16-15-19-26-23(24)25)27-22(29)18-14-11-8-6-4-2;1-3-5-7-9-10-12-13-17-21(25)20(16-15-19-23)24-22(26)18-14-11-8-6-4-2;1-3-5-6-7-8-9-10-14-18(25)23-16(17(24)12-4-2)13-11-15-22-19(20)21/h26H,3-25H2,1-2H3,(H,33,35)(H4,30,31,32);24H,3-23H2,1-2H3,(H,31,33)(H4,28,29,30);23H,3-22,26H2,1-2H3,(H,27,29);2*20H,3-19H2,1-2H3,(H,27,29)(H4,24,25,26);20H,3-19,23H2,1-2H3,(H,24,26);16H,3-15H2,1-2H3,(H,23,25)(H4,20,21,22)
InChIKeyLUZXJUKTUKKPQQ-UHFFFAOYSA-N
XLogP37.05
TPSA697.23 Ų
H-Bond Donors19
H-Bond Acceptors21
Rotatable Bonds147
Heavy Atoms206
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002916.69
LogP ≤ 537.05
H-Bond Donors ≤ 519
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide with MolForge

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Related Compounds

N-[1-(diaminomethylideneamino)-6-oxononan-5-yl]dodecanamide
CID 147790356
N-(1-amino-3-oxohexan-2-yl)dodecanamide;N-(1-amino-6-oxononan-5-yl)dodecanamide;N-(1-amino-5-oxooctan-4-yl)dodecanamide;N-[1-(diaminomethylideneamino)-6-oxononan-5-yl]dodecanamide;diaminomethylidene-[4-(octadecanoylamino)-5-oxododecyl]azanium;diaminomethylidene-[4-(octadecanoylamino)-5-oxooctyl]azanium
CID 160859405
N-[1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]undecanamide
CID 155426715
methyl (2S)-5-(diaminomethylideneamino)-2-(tridecanoylamino)pentanoate
CID 101199795
N-(1-amino-6-oxononan-5-yl)dodecanamide;diaminomethylidene-[5-oxo-4-(pentanoylamino)dodecyl]azanium;methane;N-methyldodecanamide;N-methyloctanamide;2-(4-methyl-5-oxoheptadecyl)guanidine;2-(5-methyl-6-oxononyl)guanidine;pentadecane
CID 161488881
(4S)-5-[[(2S)-6-amino-1-[[(4S)-1-chloro-7-(diaminomethylideneamino)-3-oxoheptan-4-yl]amino]-1-oxohexan-2-yl]amino]-4-[[(2S)-2-(decanoylamino)-5-(diaminomethylideneamino)pentanoyl]amino]-5-oxopentanoic acid
CID 11721925
N-[(2S)-1-[10-[[(2S)-2-(decanoylamino)-5-(diaminomethylideneamino)pentanoyl]amino]decylamino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]decanamide
CID 102585613
N-[(2S)-5-(diaminomethylideneamino)-1-(dodecylamino)-1-oxopentan-2-yl]icosanamide
CID 135363876
butyl (2S)-5-(diaminomethylideneamino)-2-(octanoylamino)pentanoate
CID 139763938
N-[(2S)-5-(diaminomethylideneamino)-1-(octylamino)-1-oxopentan-2-yl]hexadecanamide
CID 135364119
acetic acid;ethyl (2S)-5-(diaminomethylideneamino)-2-(dodecanoylamino)pentanoate
CID 72941622
N-[5-(diaminomethylideneamino)-1-(dodecylamino)-1-oxopentan-2-yl]octadecanamide;hydrochloride
CID 135363774

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide?
The IUPAC name of N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide (CID 159464538) is N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide.
What is the SMILES notation for N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide?
The canonical SMILES for N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide is CCCCCCCCCC(=O)C(CCCN)NC(=O)CCCCCCC.CCCCCCCCCC(=O)C(CCCN=C(N)N)NC(=O)CCCCCCC.CCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)CCC.CCCCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)CCCCCCCCC.CCCCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)CCCCCCCCCCC.CCCCCCCCCCCCC(=O)C(CCCN)NC(=O)CCCCCCC.CCCCCCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)CCC.
What is the InChIKey of N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide?
The InChIKey is LUZXJUKTUKKPQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H58N4O2.C27H54N4O2.C25H50N2O2.2C23H46N4O2.C22H44N2O2.C19H38N4O2/c1-3-5-7-9-11-13-15-17-19-23-27(34)26(22-21-25-32-29(30)31)33-28(35)24-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-12-14-16-18-22-26(33)31-24(20-19-23-30-27(28)29)25(32)21-17-15-13-10-8-6-4-2;1-3-5-7-9-10-11-12-13-15-16-20-24(28)23(19-18-22-26)27-25(29)21-17-14-8-6-4-2;1-3-5-6-7-8-9-10-11-12-13-14-18-22(29)27-20(21(28)16-4-2)17-15-19-26-23(24)25;1-3-5-7-9-10-12-13-17-21(28)20(16-15-19-26-23(24)25)27-22(29)18-14-11-8-6-4-2;1-3-5-7-9-10-12-13-17-21(25)20(16-15-19-23)24-22(26)18-14-11-8-6-4-2;1-3-5-6-7-8-9-10-14-18(25)23-16(17(24)12-4-2)13-11-15-22-19(20)21/h26H,3-25H2,1-2H3,(H,33,35)(H4,30,31,32);24H,3-23H2,1-2H3,(H,31,33)(H4,28,29,30);23H,3-22,26H2,1-2H3,(H,27,29);2*20H,3-19H2,1-2H3,(H,27,29)(H4,24,25,26);20H,3-19,23H2,1-2H3,(H,24,26);16H,3-15H2,1-2H3,(H,23,25)(H4,20,21,22).
What are the key properties of N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide?
N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide has a molecular weight of 2916.69 g/mol, XLogP of 37.05, 147 rotatable bonds, 19 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-5-oxoheptadecan-4-yl)octanamide;N-(1-amino-5-oxotetradecan-4-yl)octanamide;N-[1-(diaminomethylideneamino)-5-oxohexadecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]decanamide;N-[1-(diaminomethylideneamino)-5-oxooctan-4-yl]tetradecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]dodecanamide;N-[1-(diaminomethylideneamino)-5-oxotetradecan-4-yl]octanamide is sourced from PubChem (CID 159464538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).