2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide

C15H18ClN5O — CID 110107073

IUPAC2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide
SMILESO=C(Cn1cc(Cl)cn1)NC1CCCN(c2ccccn2)C1
InChIInChI=1S/C15H18ClN5O/c16-12-8-18-21(9-12)11-15(22)19-13-4-3-7-20(10-13)14-5-1-2-6-17-14/h1-2,5-6,8-9,13H,3-4,7,10-11H2,(H,19,22)
InChIKeyRIQNJIRNHMLFKH-UHFFFAOYSA-N
MW319.80 g/mol
LogP1.72
Rot. Bonds4

About 2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide

2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide (PubChem CID 110107073) has the molecular formula C15H18ClN5O and a molecular weight of 319.80 g/mol. Its IUPAC name is 2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide
PubChem CID110107073
Molecular FormulaC15H18ClN5O
Molecular Weight319.80 g/mol
Exact Mass319.12
IUPAC Name2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide
SMILESO=C(Cn1cc(Cl)cn1)NC1CCCN(c2ccccn2)C1
InChIInChI=1S/C15H18ClN5O/c16-12-8-18-21(9-12)11-15(22)19-13-4-3-7-20(10-13)14-5-1-2-6-17-14/h1-2,5-6,8-9,13H,3-4,7,10-11H2,(H,19,22)
InChIKeyRIQNJIRNHMLFKH-UHFFFAOYSA-N
XLogP1.72
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.80
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide
CID 124958753
2-(2,5-dioxoimidazolidin-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide
CID 127247784
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
2-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-3-carboxamide
CID 124573399
N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-3-thiophen-2-ylpropanamide
CID 125013076
2-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide
CID 124948305
3-(3-chloro-4-fluorophenyl)-N-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]propanamide
CID 99875625
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
3-(3,4-dichlorophenyl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)propanamide
CID 90621285
2-indol-1-yl-N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]acetamide
CID 99697341

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide?
The IUPAC name of 2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide (CID 110107073) is 2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide.
What is the SMILES notation for 2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide?
The canonical SMILES for 2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide is O=C(Cn1cc(Cl)cn1)NC1CCCN(c2ccccn2)C1.
What is the InChIKey of 2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide?
The InChIKey is RIQNJIRNHMLFKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN5O/c16-12-8-18-21(9-12)11-15(22)19-13-4-3-7-20(10-13)14-5-1-2-6-17-14/h1-2,5-6,8-9,13H,3-4,7,10-11H2,(H,19,22).
What are the key properties of 2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide?
2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide has a molecular weight of 319.80 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloropyrazol-1-yl)-N-(1-pyridin-2-ylpiperidin-3-yl)acetamide is sourced from PubChem (CID 110107073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).