2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide

C13H25N3O — CID 64824736

IUPAC2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide
SMILESCCN1CCC(CNC(=O)C2CCCC2N)C1
InChIInChI=1S/C13H25N3O/c1-2-16-7-6-10(9-16)8-15-13(17)11-4-3-5-12(11)14/h10-12H,2-9,14H2,1H3,(H,15,17)
InChIKeyNRNQIYXRAOIHOW-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.57
Rot. Bonds4

About 2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide

2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide (PubChem CID 64824736) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide
PubChem CID64824736
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide
SMILESCCN1CCC(CNC(=O)C2CCCC2N)C1
InChIInChI=1S/C13H25N3O/c1-2-16-7-6-10(9-16)8-15-13(17)11-4-3-5-12(11)14/h10-12H,2-9,14H2,1H3,(H,15,17)
InChIKeyNRNQIYXRAOIHOW-UHFFFAOYSA-N
XLogP0.57
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-ethylpyrrolidin-3-yl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 60862754
3-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119854746
2-amino-N-[(1-methylpiperidin-4-yl)methyl]cyclohexane-1-carboxamide
CID 62776858
2-amino-N-(cyclopentylmethyl)cyclopentane-1-carboxamide
CID 64822133
2-amino-N-(1-ethylpiperidin-4-yl)cyclopentane-1-carboxamide
CID 64824596
N-[(1-ethylpyrrolidin-3-yl)methyl]-6-methylpiperidine-2-carboxamide
CID 60857198
2-amino-N-(cyclohexylmethyl)cyclopentane-1-carboxamide;hydrochloride
CID 119672519
bis(N-[(1-ethylpyrrolidin-3-yl)methyl]acetamide);methane
CID 162144356
5-amino-N-[(1-ethylpiperidin-4-yl)methyl]-2,4-dimethylcyclohexane-1-carboxamide
CID 102706681
(2S)-N-[(1-ethylpyrrolidin-3-yl)methyl]piperidine-2-carboxamide
CID 113267408
cis-(1S,2R)-2-amino-N-[[1-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperidin-4-yl]methyl]cyclopentane-1-carboxamide
CID 124697126
2-amino-N-[(1-methylpyrrolidin-3-yl)methyl]cyclopropane-1-carboxamide
CID 114995517

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide (CID 64824736) is 2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide is CCN1CCC(CNC(=O)C2CCCC2N)C1.
What is the InChIKey of 2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide?
The InChIKey is NRNQIYXRAOIHOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-2-16-7-6-10(9-16)8-15-13(17)11-4-3-5-12(11)14/h10-12H,2-9,14H2,1H3,(H,15,17).
What are the key properties of 2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide?
2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 0.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 64824736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).