3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide

C14H26N2O — CID 119791641

IUPAC3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide
SMILESC=CCCCCCN(C)C(=O)C1CCC(N)C1
InChIInChI=1S/C14H26N2O/c1-3-4-5-6-7-10-16(2)14(17)12-8-9-13(15)11-12/h3,12-13H,1,4-11,15H2,2H3
InChIKeyHGCAFOJAZCOPDQ-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.32
Rot. Bonds7

About 3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide

3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide (PubChem CID 119791641) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide
PubChem CID119791641
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide
SMILESC=CCCCCCN(C)C(=O)C1CCC(N)C1
InChIInChI=1S/C14H26N2O/c1-3-4-5-6-7-10-16(2)14(17)12-8-9-13(15)11-12/h3,12-13H,1,4-11,15H2,2H3
InChIKeyHGCAFOJAZCOPDQ-UHFFFAOYSA-N
XLogP2.32
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-hex-5-enyl-3-hydroxy-N-methylcyclopentane-1-carboxamide
CID 141167486
4-[(3-aminocyclopentanecarbonyl)-methylamino]butanoic acid
CID 66009609
3-amino-N-methyl-N-propylcyclopentane-1-carboxamide
CID 66031475
3-amino-N-methyl-N-(4-phenylbutyl)cyclopentane-1-carboxamide
CID 66009595
3-amino-N-(2-cyanoethyl)-N-methylcyclopentane-1-carboxamide
CID 66033059
N-methyl-N-pent-4-enylpiperidine-4-carboxamide;hydrochloride
CID 119330191
3-amino-N-methyl-N-[2-(oxan-4-yl)ethyl]cyclopentane-1-carboxamide
CID 119798087
N-hept-6-enyl-4-hydroxy-N-methylpyrrolidine-2-carboxamide
CID 77158348
trans-(1R,3R)-3-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide
CID 97123271
3-amino-N-(2-hydroxypropyl)-N-methylcyclopentane-1-carboxamide
CID 66007556
3-amino-N-[(1-hydroxycyclopentyl)methyl]-N-methylcyclopentane-1-carboxamide
CID 114949026
3-amino-N-methyl-N-propylcyclohexane-1-carboxamide
CID 62778074

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide (CID 119791641) is 3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide is C=CCCCCCN(C)C(=O)C1CCC(N)C1.
What is the InChIKey of 3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide?
The InChIKey is HGCAFOJAZCOPDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-3-4-5-6-7-10-16(2)14(17)12-8-9-13(15)11-12/h3,12-13H,1,4-11,15H2,2H3.
What are the key properties of 3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide?
3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 2.32, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-hept-6-enyl-N-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 119791641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).