2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide

C14H24N4O — CID 65229653

IUPAC2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide
SMILESCC(C)C(CN)C(=O)NC1CCCC1n1ccnc1
InChIInChI=1S/C14H24N4O/c1-10(2)11(8-15)14(19)17-12-4-3-5-13(12)18-7-6-16-9-18/h6-7,9-13H,3-5,8,15H2,1-2H3,(H,17,19)
InChIKeyFOODRBRHSQKLIK-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.32
Rot. Bonds5

About 2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide

2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide (PubChem CID 65229653) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide
PubChem CID65229653
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide
SMILESCC(C)C(CN)C(=O)NC1CCCC1n1ccnc1
InChIInChI=1S/C14H24N4O/c1-10(2)11(8-15)14(19)17-12-4-3-5-13(12)18-7-6-16-9-18/h6-7,9-13H,3-5,8,15H2,1-2H3,(H,17,19)
InChIKeyFOODRBRHSQKLIK-UHFFFAOYSA-N
XLogP1.32
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(2-imidazol-1-ylcyclopentyl)acetamide
CID 43713486
(2R)-2-amino-N-(2-imidazol-1-ylcyclopentyl)-4-methylsulfanylbutanamide
CID 104907460
N-(2-imidazol-1-ylcyclopentyl)-2-(methylamino)acetamide
CID 43713522
N-(2-imidazol-1-ylcyclopentyl)-4-(propan-2-ylamino)butanamide
CID 60851167
2-imidazol-1-yl-N-(2-methylpropyl)cyclopentan-1-amine
CID 43734339
2-amino-N-(2-imidazol-1-ylcyclopentyl)-2-methylpentanamide
CID 60847019
(2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide
CID 136587530
2-[4-(aminomethyl)triazol-1-yl]-N-(2-imidazol-1-ylcyclopentyl)acetamide
CID 115459210
5-chloro-N-(2-imidazol-1-ylcyclopentyl)pentanamide
CID 43701618
2-imidazol-1-yl-N-(2-methylbutyl)cyclopentan-1-amine
CID 43734275
2-imidazol-1-yl-N-pentan-2-ylcyclopentan-1-amine
CID 43734394
cis-(1R,2S)-2-imidazol-1-yl-N-(3-methylbutyl)cyclohexan-1-amine
CID 165456995

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide?
The IUPAC name of 2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide (CID 65229653) is 2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide.
What is the SMILES notation for 2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide?
The canonical SMILES for 2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide is CC(C)C(CN)C(=O)NC1CCCC1n1ccnc1.
What is the InChIKey of 2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide?
The InChIKey is FOODRBRHSQKLIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-10(2)11(8-15)14(19)17-12-4-3-5-13(12)18-7-6-16-9-18/h6-7,9-13H,3-5,8,15H2,1-2H3,(H,17,19).
What are the key properties of 2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide?
2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide has a molecular weight of 264.37 g/mol, XLogP of 1.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(2-imidazol-1-ylcyclopentyl)-3-methylbutanamide is sourced from PubChem (CID 65229653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).