(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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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).