N-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide

C14H25N3O — CID 167084897

IUPACN-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide
SMILES[H]/N=C(\N1CCCC1)N(CCC)C(=O)C1CCCC1
InChIInChI=1S/C14H25N3O/c1-2-9-17(13(18)12-7-3-4-8-12)14(15)16-10-5-6-11-16/h12,15H,2-11H2,1H3/b15-14+
InChIKeyUQKFOTRXVJZCKG-CCEZHUSRSA-N
MW251.37 g/mol
LogP2.45
Rot. Bonds3

About N-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide

N-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide (PubChem CID 167084897) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is N-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide
PubChem CID167084897
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC NameN-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide
SMILES[H]/N=C(\N1CCCC1)N(CCC)C(=O)C1CCCC1
InChIInChI=1S/C14H25N3O/c1-2-9-17(13(18)12-7-3-4-8-12)14(15)16-10-5-6-11-16/h12,15H,2-11H2,1H3/b15-14+
InChIKeyUQKFOTRXVJZCKG-CCEZHUSRSA-N
XLogP2.45
TPSA47.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-butyl-1-(cyclopentanecarbonyl)-N-methylpiperidine-4-carboxamide
CID 87022999
N-acetyl-N-ethylcyclopentanecarboxamide
CID 134386083
2-[cyclopentanecarbonyl(propyl)amino]acetic acid
CID 61011527
N-(2-hydroxyethyl)-N-propylcyclopentanecarboxamide
CID 60670732
N-butyl-N-propylcyclopentanecarboxamide
CID 91693798
(3R)-1-butanoyl-N-[[(2R)-oxan-2-yl]methyl]-N-propylpiperidine-3-carboxamide
CID 95324158
N-(2-chloroethyl)-N-propylcyclohexanecarboxamide
CID 63393390
(3R)-1-(dipropylcarbamoyl)piperidine-3-carboxylic acid
CID 28512445
N-(cyclopropylmethyl)-N-propylpyrrolidine-1-carboxamide
CID 115578768
1-(cyclopropanecarbonyl)-N,N-dipropylpiperidine-4-carboxamide
CID 113005873
N-propyl-N-prop-2-ynylcycloheptanecarboxamide
CID 78917353
3-[cyclohexanecarbonyl(propyl)amino]propanoic acid
CID 82324168

Frequently Asked Questions

What is the IUPAC name of N-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide?
The IUPAC name of N-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide (CID 167084897) is N-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide.
What is the SMILES notation for N-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide?
The canonical SMILES for N-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide is [H]/N=C(\N1CCCC1)N(CCC)C(=O)C1CCCC1.
What is the InChIKey of N-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide?
The InChIKey is UQKFOTRXVJZCKG-CCEZHUSRSA-N. The full InChI is InChI=1S/C14H25N3O/c1-2-9-17(13(18)12-7-3-4-8-12)14(15)16-10-5-6-11-16/h12,15H,2-11H2,1H3/b15-14+.
What are the key properties of N-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide?
N-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide has a molecular weight of 251.37 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-N-(pyrrolidine-1-carboximidoyl)cyclopentanecarboxamide is sourced from PubChem (CID 167084897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).