butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide

C161H332N10O10 — CID 159543173

IUPACbutane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide
SMILESC.C.C=C(C)C(=O)NCCCCCCCC.C=C(C)C(=O)NCCCCCCCCC.C=C(C)C(=O)NCCCCCCCCCC.C=C(C)C(=O)NCCCCCCCCCCC.C=C(C)C(=O)NCCCCCCCCCCCC.C=CC(=O)NCCCCCCCC.C=CC(=O)NCCCCCCCCC.C=CC(=O)NCCCCCCCCCC.C=CC(=O)NCCCCCCCCCCC.C=CC(=O)NCCCCCCCCCCCC.CC.CC.CC.CCC.CCC.CCCC.CCCC.CCCC
InChIInChI=1S/C16H31NO.2C15H29NO.2C14H27NO.2C13H25NO.2C12H23NO.C11H21NO.3C4H10.2C3H8.3C2H6.2CH4/c1-4-5-6-7-8-9-10-11-12-13-14-17-16(18)15(2)3;1-4-5-6-7-8-9-10-11-12-13-16-15(17)14(2)3;1-3-5-6-7-8-9-10-11-12-13-14-16-15(17)4-2;1-4-5-6-7-8-9-10-11-12-15-14(16)13(2)3;1-3-5-6-7-8-9-10-11-12-13-15-14(16)4-2;1-4-5-6-7-8-9-10-11-14-13(15)12(2)3;1-3-5-6-7-8-9-10-11-12-14-13(15)4-2;1-4-5-6-7-8-9-10-13-12(14)11(2)3;1-3-5-6-7-8-9-10-11-13-12(14)4-2;1-3-5-6-7-8-9-10-12-11(13)4-2;3*1-3-4-2;2*1-3-2;3*1-2;;/h2,4-14H2,1,3H3,(H,17,18);2,4-13H2,1,3H3,(H,16,17);4H,2-3,5-14H2,1H3,(H,16,17);2,4-12H2,1,3H3,(H,15,16);4H,2-3,5-13H2,1H3,(H,15,16);2,4-11H2,1,3H3,(H,14,15);4H,2-3,5-12H2,1H3,(H,14,15);2,4-10H2,1,3H3,(H,13,14);4H,2-3,5-11H2,1H3,(H,13,14);4H,2-3,5-10H2,1H3,(H,12,13);3*3-4H2,1-2H3;2*3H2,1-2H3;3*1-2H3;2*1H4
InChIKeyMELXFQSSZRWRIH-UHFFFAOYSA-N
MW2568.49 g/mol
LogP48.85
Rot. Bonds103

About butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide

butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide (PubChem CID 159543173) has the molecular formula C161H332N10O10 and a molecular weight of 2568.49 g/mol. Its IUPAC name is butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide.

Molecular Properties

Compound Namebutane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide
PubChem CID159543173
Molecular FormulaC161H332N10O10
Molecular Weight2568.49 g/mol
Exact Mass2566.58
IUPAC Namebutane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide
SMILESC.C.C=C(C)C(=O)NCCCCCCCC.C=C(C)C(=O)NCCCCCCCCC.C=C(C)C(=O)NCCCCCCCCCC.C=C(C)C(=O)NCCCCCCCCCCC.C=C(C)C(=O)NCCCCCCCCCCCC.C=CC(=O)NCCCCCCCC.C=CC(=O)NCCCCCCCCC.C=CC(=O)NCCCCCCCCCC.C=CC(=O)NCCCCCCCCCCC.C=CC(=O)NCCCCCCCCCCCC.CC.CC.CC.CCC.CCC.CCCC.CCCC.CCCC
InChIInChI=1S/C16H31NO.2C15H29NO.2C14H27NO.2C13H25NO.2C12H23NO.C11H21NO.3C4H10.2C3H8.3C2H6.2CH4/c1-4-5-6-7-8-9-10-11-12-13-14-17-16(18)15(2)3;1-4-5-6-7-8-9-10-11-12-13-16-15(17)14(2)3;1-3-5-6-7-8-9-10-11-12-13-14-16-15(17)4-2;1-4-5-6-7-8-9-10-11-12-15-14(16)13(2)3;1-3-5-6-7-8-9-10-11-12-13-15-14(16)4-2;1-4-5-6-7-8-9-10-11-14-13(15)12(2)3;1-3-5-6-7-8-9-10-11-12-14-13(15)4-2;1-4-5-6-7-8-9-10-13-12(14)11(2)3;1-3-5-6-7-8-9-10-11-13-12(14)4-2;1-3-5-6-7-8-9-10-12-11(13)4-2;3*1-3-4-2;2*1-3-2;3*1-2;;/h2,4-14H2,1,3H3,(H,17,18);2,4-13H2,1,3H3,(H,16,17);4H,2-3,5-14H2,1H3,(H,16,17);2,4-12H2,1,3H3,(H,15,16);4H,2-3,5-13H2,1H3,(H,15,16);2,4-11H2,1,3H3,(H,14,15);4H,2-3,5-12H2,1H3,(H,14,15);2,4-10H2,1,3H3,(H,13,14);4H,2-3,5-11H2,1H3,(H,13,14);4H,2-3,5-10H2,1H3,(H,12,13);3*3-4H2,1-2H3;2*3H2,1-2H3;3*1-2H3;2*1H4
InChIKeyMELXFQSSZRWRIH-UHFFFAOYSA-N
XLogP48.85
TPSA291.00 Ų
H-Bond Donors10
H-Bond Acceptors10
Rotatable Bonds103
Heavy Atoms181
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002568.49
LogP ≤ 548.85
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide with MolForge

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Related Compounds

N-heptadecylprop-2-enamide
CID 20727742
N-icosyl-2-methylprop-2-enamide
CID 22336363
carbonic acid;N-hexylprop-2-enamide
CID 22445987
N-[3-(hexylamino)propyl]prop-2-enamide
CID 87503959
N-[(Z)-nonadec-10-enyl]prop-2-enamide
CID 87771405
2-methyl-N-[3-(pentylamino)propyl]prop-2-enamide
CID 87504173
N-[3-(dioctylamino)propyl]prop-2-enamide
CID 54306964
2-methyl-N-[3-(octadecylamino)-3-oxopropyl]prop-2-enamide
CID 176871830
N-butylprop-2-enamide;hydrofluoride
CID 174533496
N-[12-(prop-2-enoylamino)dodecyl]prop-2-enamide;N-[9-(prop-2-enoylamino)nonyl]prop-2-enamide
CID 159527537
N-ethenyl-N-methylacetamide;N-octadecylprop-2-enamide
CID 138470318
N-butyl-2-methylprop-2-enamide;2-methylbut-2-ene
CID 174789419

Frequently Asked Questions

What is the IUPAC name of butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide?
The IUPAC name of butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide (CID 159543173) is butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide.
What is the SMILES notation for butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide?
The canonical SMILES for butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide is C.C.C=C(C)C(=O)NCCCCCCCC.C=C(C)C(=O)NCCCCCCCCC.C=C(C)C(=O)NCCCCCCCCCC.C=C(C)C(=O)NCCCCCCCCCCC.C=C(C)C(=O)NCCCCCCCCCCCC.C=CC(=O)NCCCCCCCC.C=CC(=O)NCCCCCCCCC.C=CC(=O)NCCCCCCCCCC.C=CC(=O)NCCCCCCCCCCC.C=CC(=O)NCCCCCCCCCCCC.CC.CC.CC.CCC.CCC.CCCC.CCCC.CCCC.
What is the InChIKey of butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide?
The InChIKey is MELXFQSSZRWRIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO.2C15H29NO.2C14H27NO.2C13H25NO.2C12H23NO.C11H21NO.3C4H10.2C3H8.3C2H6.2CH4/c1-4-5-6-7-8-9-10-11-12-13-14-17-16(18)15(2)3;1-4-5-6-7-8-9-10-11-12-13-16-15(17)14(2)3;1-3-5-6-7-8-9-10-11-12-13-14-16-15(17)4-2;1-4-5-6-7-8-9-10-11-12-15-14(16)13(2)3;1-3-5-6-7-8-9-10-11-12-13-15-14(16)4-2;1-4-5-6-7-8-9-10-11-14-13(15)12(2)3;1-3-5-6-7-8-9-10-11-12-14-13(15)4-2;1-4-5-6-7-8-9-10-13-12(14)11(2)3;1-3-5-6-7-8-9-10-11-13-12(14)4-2;1-3-5-6-7-8-9-10-12-11(13)4-2;3*1-3-4-2;2*1-3-2;3*1-2;;/h2,4-14H2,1,3H3,(H,17,18);2,4-13H2,1,3H3,(H,16,17);4H,2-3,5-14H2,1H3,(H,16,17);2,4-12H2,1,3H3,(H,15,16);4H,2-3,5-13H2,1H3,(H,15,16);2,4-11H2,1,3H3,(H,14,15);4H,2-3,5-12H2,1H3,(H,14,15);2,4-10H2,1,3H3,(H,13,14);4H,2-3,5-11H2,1H3,(H,13,14);4H,2-3,5-10H2,1H3,(H,12,13);3*3-4H2,1-2H3;2*3H2,1-2H3;3*1-2H3;2*1H4.
What are the key properties of butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide?
butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide has a molecular weight of 2568.49 g/mol, XLogP of 48.85, 103 rotatable bonds, 10 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for butane;N-decyl-2-methylprop-2-enamide;N-decylprop-2-enamide;N-dodecyl-2-methylprop-2-enamide;N-dodecylprop-2-enamide;ethane;methane;2-methyl-N-nonylprop-2-enamide;2-methyl-N-octylprop-2-enamide;2-methyl-N-undecylprop-2-enamide;N-nonylprop-2-enamide;N-octylprop-2-enamide;propane;N-undecylprop-2-enamide is sourced from PubChem (CID 159543173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).