2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide

C16H21N5O — CID 124958753

IUPAC2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide
SMILESCc1nccn1CC(=O)N[C@@H]1CCCN(c2ccccn2)C1
InChIInChI=1S/C16H21N5O/c1-13-17-8-10-20(13)12-16(22)19-14-5-4-9-21(11-14)15-6-2-3-7-18-15/h2-3,6-8,10,14H,4-5,9,11-12H2,1H3,(H,19,22)/t14-/m1/s1
InChIKeyGIKYQHPIQIFGEB-CQSZACIVSA-N
MW299.38 g/mol
LogP1.37
Rot. Bonds4

About 2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide

2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide (PubChem CID 124958753) has the molecular formula C16H21N5O and a molecular weight of 299.38 g/mol. Its IUPAC name is 2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide.

Molecular Properties

Compound Name2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide
PubChem CID124958753
Molecular FormulaC16H21N5O
Molecular Weight299.38 g/mol
Exact Mass299.17
IUPAC Name2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide
SMILESCc1nccn1CC(=O)N[C@@H]1CCCN(c2ccccn2)C1
InChIInChI=1S/C16H21N5O/c1-13-17-8-10-20(13)12-16(22)19-14-5-4-9-21(11-14)15-6-2-3-7-18-15/h2-3,6-8,10,14H,4-5,9,11-12H2,1H3,(H,19,22)/t14-/m1/s1
InChIKeyGIKYQHPIQIFGEB-CQSZACIVSA-N
XLogP1.37
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide
CID 124948305
2-(2,5-dioxoimidazolidin-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide
CID 127247784
2-indol-1-yl-N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]acetamide
CID 99697341
2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide
CID 110107073
N-cyclopropyl-2-(2-methylimidazol-1-yl)acetamide
CID 60731702
3-phenoxy-N-(1-pyridin-2-ylpiperidin-3-yl)propanamide
CID 110107081
N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-2-thiophen-3-ylacetamide
CID 124573434
N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-3-thiophen-2-ylpropanamide
CID 125013076
3,5-dimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide
CID 124573326
2-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-3-carboxamide
CID 124573399
3-cyclohexyl-N-(1-pyridin-2-ylpyrrolidin-3-yl)propanamide
CID 90621185
2-(1-hydroxycyclohexyl)-N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]acetamide
CID 97241202

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide?
The IUPAC name of 2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide (CID 124958753) is 2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide.
What is the SMILES notation for 2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide?
The canonical SMILES for 2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide is Cc1nccn1CC(=O)N[C@@H]1CCCN(c2ccccn2)C1.
What is the InChIKey of 2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide?
The InChIKey is GIKYQHPIQIFGEB-CQSZACIVSA-N. The full InChI is InChI=1S/C16H21N5O/c1-13-17-8-10-20(13)12-16(22)19-14-5-4-9-21(11-14)15-6-2-3-7-18-15/h2-3,6-8,10,14H,4-5,9,11-12H2,1H3,(H,19,22)/t14-/m1/s1.
What are the key properties of 2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide?
2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide has a molecular weight of 299.38 g/mol, XLogP of 1.37, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide is sourced from PubChem (CID 124958753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).