(4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide

C17H20N4O2 — CID 97313572

IUPAC(4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide
SMILESCN1CC[C@@H](C(=O)Nc2nccn2Cc2ccccc2)CC1=O
InChIInChI=1S/C17H20N4O2/c1-20-9-7-14(11-15(20)22)16(23)19-17-18-8-10-21(17)12-13-5-3-2-4-6-13/h2-6,8,10,14H,7,9,11-12H2,1H3,(H,18,19,23)/t14-/m1/s1
InChIKeyVQTQEQDCXWHZOK-CQSZACIVSA-N
MW312.37 g/mol
LogP1.74
Rot. Bonds4

About (4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide

(4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide (PubChem CID 97313572) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is (4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide.

Molecular Properties

Compound Name(4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide
PubChem CID97313572
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC Name(4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide
SMILESCN1CC[C@@H](C(=O)Nc2nccn2Cc2ccccc2)CC1=O
InChIInChI=1S/C17H20N4O2/c1-20-9-7-14(11-15(20)22)16(23)19-17-18-8-10-21(17)12-13-5-3-2-4-6-13/h2-6,8,10,14H,7,9,11-12H2,1H3,(H,18,19,23)/t14-/m1/s1
InChIKeyVQTQEQDCXWHZOK-CQSZACIVSA-N
XLogP1.74
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-benzylimidazol-2-yl)piperidine-3-carboxamide
CID 119297675
(2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide
CID 94211931
1-methyl-2-oxo-N-(2-phenylmethoxy-3-pyridinyl)piperidine-4-carboxamide
CID 75461391
2-[2-[[(4S)-1-methyl-2-oxopiperidine-4-carbonyl]amino]phenyl]acetic acid
CID 129467310
(2R)-2-[[(4S)-1-methyl-2-oxopiperidine-4-carbonyl]amino]-3-phenylpropanoic acid
CID 97215052
N-(1H-benzimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide
CID 47154418
1-amino-N-(1-benzylimidazol-2-yl)cyclopropane-1-carboxamide
CID 119738584
N-(2,2-diphenylethyl)-1-methyl-2-oxopiperidine-4-carboxamide
CID 75460632
N-[1-[(2-chlorophenyl)methyl]imidazol-2-yl]-2-hydroxycyclopentane-1-carboxamide
CID 110015849
benzyl 4-[(1-methylimidazol-2-yl)carbamoyl]piperidine-1-carboxylate
CID 122152865
(4S)-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-1-methyl-2-oxopiperidine-4-carboxamide
CID 94036187
(4R)-N-[[3-(imidazol-1-ylmethyl)phenyl]methyl]-1-methyl-2-oxopiperidine-4-carboxamide
CID 94144419

Frequently Asked Questions

What is the IUPAC name of (4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide?
The IUPAC name of (4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide (CID 97313572) is (4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide.
What is the SMILES notation for (4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide?
The canonical SMILES for (4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide is CN1CC[C@@H](C(=O)Nc2nccn2Cc2ccccc2)CC1=O.
What is the InChIKey of (4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide?
The InChIKey is VQTQEQDCXWHZOK-CQSZACIVSA-N. The full InChI is InChI=1S/C17H20N4O2/c1-20-9-7-14(11-15(20)22)16(23)19-17-18-8-10-21(17)12-13-5-3-2-4-6-13/h2-6,8,10,14H,7,9,11-12H2,1H3,(H,18,19,23)/t14-/m1/s1.
What are the key properties of (4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide?
(4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide is sourced from PubChem (CID 97313572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).