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

C11H18N4O — CID 64824865

IUPAC2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide
SMILESCn1ccnc1CNC(=O)C1CCCC1N
InChIInChI=1S/C11H18N4O/c1-15-6-5-13-10(15)7-14-11(16)8-3-2-4-9(8)12/h5-6,8-9H,2-4,7,12H2,1H3,(H,14,16)
InChIKeyGQKAFRPFXBYWFB-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.16
Rot. Bonds3

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

2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide (PubChem CID 64824865) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide
PubChem CID64824865
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide
SMILESCn1ccnc1CNC(=O)C1CCCC1N
InChIInChI=1S/C11H18N4O/c1-15-6-5-13-10(15)7-14-11(16)8-3-2-4-9(8)12/h5-6,8-9H,2-4,7,12H2,1H3,(H,14,16)
InChIKeyGQKAFRPFXBYWFB-UHFFFAOYSA-N
XLogP0.16
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 7068386
N-({(2S,4S)-4-fluoro-1-[4-(2-methyl-1H-imidazol-1-yl)butanoyl]pyrrolidin-2-yl}methyl)-3-methylbutanamide
CID 70755207
1-(1-Imidazol-1-ylpropan-2-yl)-3-[2-(2-oxoazepan-1-yl)ethyl]urea
CID 71894674
N-[rel-(3R,4S)-1-cyclopentyl-4-cyclopropyl-3-pyrrolidinyl]-4-(1H-imidazol-1-yl)butanamide dihydrochloride
CID 72852975
1-(cyclopentylcarbonyl)-N-methyl-N-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-4-piperidinecarboxamide
CID 72913891
N-hydroxy-N'-(3-imidazol-1-ylpropyl)-2-(2-methylpropyl)propanediamide
CID 178311211
rac-(4R,5S)-4-(aminomethyl)-1-methyl-5-(1-methyl-1H-imidazol-2-yl)pyrrolidin-2-one dihydrochloride
CID 121552999
rac-(5R,6S)-5-(aminomethyl)-1-cyclopropyl-6-(1-methyl-1H-imidazol-2-yl)piperidin-2-one
CID 125424778
N-({1-[(1-isopropyl-1H-imidazol-2-yl)methyl]piperidin-4-yl}methyl)-2,2-dimethylpropanamide
CID 56742435
2-[1-(cyclohexylmethyl)-3-oxo-2-piperazinyl]-N-[(1-methyl-1H-imidazol-2-yl)methyl]-N-propylacetamide
CID 56892678
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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide (CID 64824865) is 2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide is Cn1ccnc1CNC(=O)C1CCCC1N.
What is the InChIKey of 2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide?
The InChIKey is GQKAFRPFXBYWFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-15-6-5-13-10(15)7-14-11(16)8-3-2-4-9(8)12/h5-6,8-9H,2-4,7,12H2,1H3,(H,14,16).
What are the key properties of 2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide?
2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(1-methylimidazol-2-yl)methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 64824865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).