N,N-bis(6-methylhept-5-en-2-yl)formamide

C17H31NO — CID 2867109

IUPACN,N-bis(6-methylhept-5-en-2-yl)formamide
SMILESCC(C)=CCCC(C)N(C=O)C(C)CCC=C(C)C
InChIInChI=1S/C17H31NO/c1-14(2)9-7-11-16(5)18(13-19)17(6)12-8-10-15(3)4/h9-10,13,16-17H,7-8,11-12H2,1-6H3
InChIKeyDPLSPVPSCNGGTJ-UHFFFAOYSA-N
MW265.44 g/mol
LogP4.71
Rot. Bonds9

About N,N-bis(6-methylhept-5-en-2-yl)formamide

N,N-bis(6-methylhept-5-en-2-yl)formamide (PubChem CID 2867109) has the molecular formula C17H31NO and a molecular weight of 265.44 g/mol. Its IUPAC name is N,N-bis(6-methylhept-5-en-2-yl)formamide.

Molecular Properties

Compound NameN,N-bis(6-methylhept-5-en-2-yl)formamide
PubChem CID2867109
Molecular FormulaC17H31NO
Molecular Weight265.44 g/mol
Exact Mass265.24
IUPAC NameN,N-bis(6-methylhept-5-en-2-yl)formamide
SMILESCC(C)=CCCC(C)N(C=O)C(C)CCC=C(C)C
InChIInChI=1S/C17H31NO/c1-14(2)9-7-11-16(5)18(13-19)17(6)12-8-10-15(3)4/h9-10,13,16-17H,7-8,11-12H2,1-6H3
InChIKeyDPLSPVPSCNGGTJ-UHFFFAOYSA-N
XLogP4.71
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,6-dimethylhept-5-enal
CID 158364508
2-ethyl-2,3,7-trimethyloct-6-enal
CID 54472042
N,N-bis(4-methylpentan-2-yl)formamide
CID 57421709
4,8-dimethylnon-7-en-3-ol
CID 3015366
6-methylhept-5-en-2-yl propanoate
CID 3020294
(1E,3R)-N,N-diethyl-3,7-dimethylocta-1,6-dien-1-amine
CID 11042011
1-hydroxy-3,7-dimethyloct-6-en-2-one
CID 15409470
S-(6-methylhept-5-en-2-yl) ethanethioate
CID 10559479
(2R)-2,6-dimethylhept-5-en-1-amine
CID 163211564
3,7-dimethyl-2-propyloct-6-enoic acid
CID 91153556
2,6-dimethylhept-5-enoxy(triethyl)silane
CID 86242000
3,7-dimethyloct-6-en-1-ol;hexanal
CID 88603702

Frequently Asked Questions

What is the IUPAC name of N,N-bis(6-methylhept-5-en-2-yl)formamide?
The IUPAC name of N,N-bis(6-methylhept-5-en-2-yl)formamide (CID 2867109) is N,N-bis(6-methylhept-5-en-2-yl)formamide.
What is the SMILES notation for N,N-bis(6-methylhept-5-en-2-yl)formamide?
The canonical SMILES for N,N-bis(6-methylhept-5-en-2-yl)formamide is CC(C)=CCCC(C)N(C=O)C(C)CCC=C(C)C.
What is the InChIKey of N,N-bis(6-methylhept-5-en-2-yl)formamide?
The InChIKey is DPLSPVPSCNGGTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31NO/c1-14(2)9-7-11-16(5)18(13-19)17(6)12-8-10-15(3)4/h9-10,13,16-17H,7-8,11-12H2,1-6H3.
What are the key properties of N,N-bis(6-methylhept-5-en-2-yl)formamide?
N,N-bis(6-methylhept-5-en-2-yl)formamide has a molecular weight of 265.44 g/mol, XLogP of 4.71, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(6-methylhept-5-en-2-yl)formamide is sourced from PubChem (CID 2867109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).