4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide

C224H446N12O12 — CID 123155920

IUPAC4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide
SMILESCCCCCCCCCCCCCCNC(=O)CCC(CCC(=O)NCCCCCCCCCCCCCC)CCC(CCC(=O)NCCCCCCCCCCCCCC)CCC(=O)NCCCCCCCCCCCCCC.CCCCCCCCCCCCCCNC(=O)CCC(CCC)CCC(=O)NCCCCCCCCCCCCCC.CCCCCCCCCCCCCCNC(=O)CCCCCC.CCCCCCCCCCCCCCNC(=O)CCCCCC(CCC(=O)NCCCCCCCCCCCCCC)CCC(=O)NCCCCCCCCCCCCCC.CCCCCCCCCCCCCCNC(=O)CCCCCCCCC(=O)NCCCCCCCCCCCCCC
InChIInChI=1S/C72H142N4O4.C55H109N3O3.2C38H76N2O2.C21H43NO/c1-5-9-13-17-21-25-29-33-37-41-45-49-63-73-69(77)59-55-67(56-60-70(78)74-64-50-46-42-38-34-30-26-22-18-14-10-6-2)53-54-68(57-61-71(79)75-65-51-47-43-39-35-31-27-23-19-15-11-7-3)58-62-72(80)76-66-52-48-44-40-36-32-28-24-20-16-12-8-4;1-4-7-10-13-16-19-22-25-28-31-34-40-49-56-53(59)44-39-37-38-43-52(45-47-54(60)57-50-41-35-32-29-26-23-20-17-14-11-8-5-2)46-48-55(61)58-51-42-36-33-30-27-24-21-18-15-12-9-6-3;1-4-7-9-11-13-15-17-19-21-23-25-27-34-39-37(41)32-30-36(29-6-3)31-33-38(42)40-35-28-26-24-22-20-18-16-14-12-10-8-5-2;1-3-5-7-9-11-13-15-17-19-23-27-31-35-39-37(41)33-29-25-21-22-26-30-34-38(42)40-36-32-28-24-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-10-11-12-13-14-15-16-18-20-22-21(23)19-17-8-6-4-2/h67-68H,5-66H2,1-4H3,(H,73,77)(H,74,78)(H,75,79)(H,76,80);52H,4-51H2,1-3H3,(H,56,59)(H,57,60)(H,58,61);36H,4-35H2,1-3H3,(H,39,41)(H,40,42);3-36H2,1-2H3,(H,39,41)(H,40,42);3-20H2,1-2H3,(H,22,23)
InChIKeyOVABZLXIDCNRAT-UHFFFAOYSA-N
MW3500.10 g/mol
LogP68.07
Rot. Bonds205

About 4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide

4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide (PubChem CID 123155920) has the molecular formula C224H446N12O12 and a molecular weight of 3500.10 g/mol. Its IUPAC name is 4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide.

Molecular Properties

Compound Name4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide
PubChem CID123155920
Molecular FormulaC224H446N12O12
Molecular Weight3500.10 g/mol
Exact Mass3497.47
IUPAC Name4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide
SMILESCCCCCCCCCCCCCCNC(=O)CCC(CCC(=O)NCCCCCCCCCCCCCC)CCC(CCC(=O)NCCCCCCCCCCCCCC)CCC(=O)NCCCCCCCCCCCCCC.CCCCCCCCCCCCCCNC(=O)CCC(CCC)CCC(=O)NCCCCCCCCCCCCCC.CCCCCCCCCCCCCCNC(=O)CCCCCC.CCCCCCCCCCCCCCNC(=O)CCCCCC(CCC(=O)NCCCCCCCCCCCCCC)CCC(=O)NCCCCCCCCCCCCCC.CCCCCCCCCCCCCCNC(=O)CCCCCCCCC(=O)NCCCCCCCCCCCCCC
InChIInChI=1S/C72H142N4O4.C55H109N3O3.2C38H76N2O2.C21H43NO/c1-5-9-13-17-21-25-29-33-37-41-45-49-63-73-69(77)59-55-67(56-60-70(78)74-64-50-46-42-38-34-30-26-22-18-14-10-6-2)53-54-68(57-61-71(79)75-65-51-47-43-39-35-31-27-23-19-15-11-7-3)58-62-72(80)76-66-52-48-44-40-36-32-28-24-20-16-12-8-4;1-4-7-10-13-16-19-22-25-28-31-34-40-49-56-53(59)44-39-37-38-43-52(45-47-54(60)57-50-41-35-32-29-26-23-20-17-14-11-8-5-2)46-48-55(61)58-51-42-36-33-30-27-24-21-18-15-12-9-6-3;1-4-7-9-11-13-15-17-19-21-23-25-27-34-39-37(41)32-30-36(29-6-3)31-33-38(42)40-35-28-26-24-22-20-18-16-14-12-10-8-5-2;1-3-5-7-9-11-13-15-17-19-23-27-31-35-39-37(41)33-29-25-21-22-26-30-34-38(42)40-36-32-28-24-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-10-11-12-13-14-15-16-18-20-22-21(23)19-17-8-6-4-2/h67-68H,5-66H2,1-4H3,(H,73,77)(H,74,78)(H,75,79)(H,76,80);52H,4-51H2,1-3H3,(H,56,59)(H,57,60)(H,58,61);36H,4-35H2,1-3H3,(H,39,41)(H,40,42);3-36H2,1-2H3,(H,39,41)(H,40,42);3-20H2,1-2H3,(H,22,23)
InChIKeyOVABZLXIDCNRAT-UHFFFAOYSA-N
XLogP68.07
TPSA349.20 Ų
H-Bond Donors12
H-Bond Acceptors12
Rotatable Bonds205
Heavy Atoms248
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003500.10
LogP ≤ 568.07
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze 4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide with MolForge

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Related Compounds

N-hexyl-6-methylheptanamide
CID 141197249
N-[8-(heptanoylamino)octyl]heptanamide
CID 3252783
N-octadecyloctanamide
CID 5161729
N-[6-(pentadecanoylamino)hexyl]pentadecanamide
CID 102117556
N-dodecylhexanamide
CID 3362981
N,N'-dihexadecyldecanediamide
CID 17080069
N-[8-(dodecanoylamino)octyl]dodecanamide
CID 3273664
N-tetradecyloctanamide
CID 151737522
N-[6-(tricosanoylamino)hexyl]tricosanamide
CID 102117558
N-[4-(heptanoylamino)butyl]heptanamide
CID 3363703
N-nonyltridecanamide
CID 154228217
N-pentylicosanamide
CID 139961886

Frequently Asked Questions

What is the IUPAC name of 4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide?
The IUPAC name of 4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide (CID 123155920) is 4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide.
What is the SMILES notation for 4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide?
The canonical SMILES for 4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide is CCCCCCCCCCCCCCNC(=O)CCC(CCC(=O)NCCCCCCCCCCCCCC)CCC(CCC(=O)NCCCCCCCCCCCCCC)CCC(=O)NCCCCCCCCCCCCCC.CCCCCCCCCCCCCCNC(=O)CCC(CCC)CCC(=O)NCCCCCCCCCCCCCC.CCCCCCCCCCCCCCNC(=O)CCCCCC.CCCCCCCCCCCCCCNC(=O)CCCCCC(CCC(=O)NCCCCCCCCCCCCCC)CCC(=O)NCCCCCCCCCCCCCC.CCCCCCCCCCCCCCNC(=O)CCCCCCCCC(=O)NCCCCCCCCCCCCCC.
What is the InChIKey of 4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide?
The InChIKey is OVABZLXIDCNRAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H142N4O4.C55H109N3O3.2C38H76N2O2.C21H43NO/c1-5-9-13-17-21-25-29-33-37-41-45-49-63-73-69(77)59-55-67(56-60-70(78)74-64-50-46-42-38-34-30-26-22-18-14-10-6-2)53-54-68(57-61-71(79)75-65-51-47-43-39-35-31-27-23-19-15-11-7-3)58-62-72(80)76-66-52-48-44-40-36-32-28-24-20-16-12-8-4;1-4-7-10-13-16-19-22-25-28-31-34-40-49-56-53(59)44-39-37-38-43-52(45-47-54(60)57-50-41-35-32-29-26-23-20-17-14-11-8-5-2)46-48-55(61)58-51-42-36-33-30-27-24-21-18-15-12-9-6-3;1-4-7-9-11-13-15-17-19-21-23-25-27-34-39-37(41)32-30-36(29-6-3)31-33-38(42)40-35-28-26-24-22-20-18-16-14-12-10-8-5-2;1-3-5-7-9-11-13-15-17-19-23-27-31-35-39-37(41)33-29-25-21-22-26-30-34-38(42)40-36-32-28-24-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-10-11-12-13-14-15-16-18-20-22-21(23)19-17-8-6-4-2/h67-68H,5-66H2,1-4H3,(H,73,77)(H,74,78)(H,75,79)(H,76,80);52H,4-51H2,1-3H3,(H,56,59)(H,57,60)(H,58,61);36H,4-35H2,1-3H3,(H,39,41)(H,40,42);3-36H2,1-2H3,(H,39,41)(H,40,42);3-20H2,1-2H3,(H,22,23).
What are the key properties of 4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide?
4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide has a molecular weight of 3500.10 g/mol, XLogP of 68.07, 205 rotatable bonds, 12 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-bis[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;N,N'-di(tetradecyl)decanediamide;4-[3-oxo-3-(tetradecylamino)propyl]-N,N'-di(tetradecyl)decanediamide;4-propyl-N,N'-di(tetradecyl)heptanediamide;N-tetradecylheptanamide is sourced from PubChem (CID 123155920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).