N-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide

C16H26N4O — CID 125446440

IUPACN-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide
SMILESCc1ncn(C)c1C(=O)NC[C@H]1CCN(C2CCCC2)C1
InChIInChI=1S/C16H26N4O/c1-12-15(19(2)11-18-12)16(21)17-9-13-7-8-20(10-13)14-5-3-4-6-14/h11,13-14H,3-10H2,1-2H3,(H,17,21)/t13-/m1/s1
InChIKeyNOKFYRXZVRFBMN-CYBMUJFWSA-N
MW290.41 g/mol
LogP1.72
Rot. Bonds4

About N-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide

N-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide (PubChem CID 125446440) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide.

Molecular Properties

Compound NameN-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide
PubChem CID125446440
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide
SMILESCc1ncn(C)c1C(=O)NC[C@H]1CCN(C2CCCC2)C1
InChIInChI=1S/C16H26N4O/c1-12-15(19(2)11-18-12)16(21)17-9-13-7-8-20(10-13)14-5-3-4-6-14/h11,13-14H,3-10H2,1-2H3,(H,17,21)/t13-/m1/s1
InChIKeyNOKFYRXZVRFBMN-CYBMUJFWSA-N
XLogP1.72
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[(2S)-1-cyclopentylpiperidin-2-yl]ethyl]-3,5-dimethylimidazole-4-carboxamide
CID 125161016
N-[(1-cyclohexylpyrrolidin-3-yl)methyl]pyrimidine-5-carboxamide
CID 122564823
N-[[(3R)-1-cyclohexylpyrrolidin-3-yl]methyl]-2H-triazole-4-carboxamide
CID 125439680
3-amino-N-[[(3S)-1-cyclopentylpyrrolidin-3-yl]methyl]-1H-pyrazole-5-carboxamide
CID 125157238
N-[[(3S)-1-cyclopentylpyrrolidin-3-yl]methyl]-2-(2,5-dimethylphenyl)acetamide
CID 125164756
N-[[(3S)-1-cyclopentylpyrrolidin-3-yl]methyl]-2-(4-hydroxyphenyl)acetamide
CID 125155819
N-[[(3R)-1-cyclohexylpyrrolidin-3-yl]methyl]-3-(5-methyl-2-pyridinyl)benzamide
CID 125162133
N-[[(3S)-1-cyclopentylpyrrolidin-3-yl]methyl]-3-methoxypropanamide
CID 125446366
N-[[(3S)-1-cyclopentylpyrrolidin-3-yl]methyl]-N',N'-diethyloxamide
CID 95216515
N-[[(3S)-1-cyclopropylpyrrolidin-3-yl]methyl]-2,5-dimethylthiophene-3-carboxamide
CID 95303166
N-[(1-cyclohexylpyrrolidin-3-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide
CID 91772553
N-[(1-cyclohexylpyrrolidin-3-yl)methyl]-3-(1,2,4-triazol-4-yl)benzamide
CID 118765014

Frequently Asked Questions

What is the IUPAC name of N-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide?
The IUPAC name of N-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide (CID 125446440) is N-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide.
What is the SMILES notation for N-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide?
The canonical SMILES for N-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide is Cc1ncn(C)c1C(=O)NC[C@H]1CCN(C2CCCC2)C1.
What is the InChIKey of N-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide?
The InChIKey is NOKFYRXZVRFBMN-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H26N4O/c1-12-15(19(2)11-18-12)16(21)17-9-13-7-8-20(10-13)14-5-3-4-6-14/h11,13-14H,3-10H2,1-2H3,(H,17,21)/t13-/m1/s1.
What are the key properties of N-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide?
N-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(3R)-1-cyclopentylpyrrolidin-3-yl]methyl]-3,5-dimethylimidazole-4-carboxamide is sourced from PubChem (CID 125446440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).