1-amino-N,N-dipentylcyclopropane-1-carboxamide

C14H28N2O — CID 65463625

IUPAC1-amino-N,N-dipentylcyclopropane-1-carboxamide
SMILESCCCCCN(CCCCC)C(=O)C1(N)CC1
InChIInChI=1S/C14H28N2O/c1-3-5-7-11-16(12-8-6-4-2)13(17)14(15)9-10-14/h3-12,15H2,1-2H3
InChIKeyWEKSNXIQSYFVHH-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.69
Rot. Bonds9

About 1-amino-N,N-dipentylcyclopropane-1-carboxamide

1-amino-N,N-dipentylcyclopropane-1-carboxamide (PubChem CID 65463625) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-amino-N,N-dipentylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N,N-dipentylcyclopropane-1-carboxamide
PubChem CID65463625
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name1-amino-N,N-dipentylcyclopropane-1-carboxamide
SMILESCCCCCN(CCCCC)C(=O)C1(N)CC1
InChIInChI=1S/C14H28N2O/c1-3-5-7-11-16(12-8-6-4-2)13(17)14(15)9-10-14/h3-12,15H2,1-2H3
InChIKeyWEKSNXIQSYFVHH-UHFFFAOYSA-N
XLogP2.69
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-amino-N-heptyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide
CID 60953140
1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide
CID 65466619
1-amino-N,N-dipropylcyclobutane-1-carboxamide
CID 81167159
1-amino-3-methyl-N,N-dipentylcyclohexane-1-carboxamide
CID 64549829
1-amino-N-[2-(dimethylamino)ethyl]-N-propylcyclobutane-1-carboxamide
CID 81169609
2-amino-1-methyl-N,N-dipentylcyclopentane-1-carboxamide
CID 82763489
1-(aminomethyl)-N-hexyl-N-(2-hydroxyethyl)cyclopentane-1-carboxamide
CID 115435051
1-(aminomethyl)-N-heptyl-N-(3-hydroxypropyl)cyclopentane-1-carboxamide
CID 115435070
1-[6-[carbamoyl(octadecyl)amino]hexyl]-1-octadecylurea
CID 87213493
1-(1-aminocyclopropyl)tridecan-1-one
CID 116576674
1-amino-N-propan-2-yl-N-propylcyclopropane-1-carboxamide
CID 65466563
N,N,N',N'-tetrahexyloxamide
CID 6424911

Frequently Asked Questions

What is the IUPAC name of 1-amino-N,N-dipentylcyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N,N-dipentylcyclopropane-1-carboxamide (CID 65463625) is 1-amino-N,N-dipentylcyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N,N-dipentylcyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N,N-dipentylcyclopropane-1-carboxamide is CCCCCN(CCCCC)C(=O)C1(N)CC1.
What is the InChIKey of 1-amino-N,N-dipentylcyclopropane-1-carboxamide?
The InChIKey is WEKSNXIQSYFVHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-5-7-11-16(12-8-6-4-2)13(17)14(15)9-10-14/h3-12,15H2,1-2H3.
What are the key properties of 1-amino-N,N-dipentylcyclopropane-1-carboxamide?
1-amino-N,N-dipentylcyclopropane-1-carboxamide has a molecular weight of 240.39 g/mol, XLogP of 2.69, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N,N-dipentylcyclopropane-1-carboxamide is sourced from PubChem (CID 65463625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).