3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide

C16H21N5O — CID 95827035

IUPAC3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide
SMILESO=C(CCc1cccc(C2CCNCC2)n1)Nc1cn[nH]c1
InChIInChI=1S/C16H21N5O/c22-16(21-14-10-18-19-11-14)5-4-13-2-1-3-15(20-13)12-6-8-17-9-7-12/h1-3,10-12,17H,4-9H2,(H,18,19)(H,21,22)
InChIKeyUZWNHRZRINAGEB-UHFFFAOYSA-N
MW299.38 g/mol
LogP1.84
Rot. Bonds5

About 3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide

3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide (PubChem CID 95827035) has the molecular formula C16H21N5O and a molecular weight of 299.38 g/mol. Its IUPAC name is 3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide.

Molecular Properties

Compound Name3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide
PubChem CID95827035
Molecular FormulaC16H21N5O
Molecular Weight299.38 g/mol
Exact Mass299.17
IUPAC Name3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide
SMILESO=C(CCc1cccc(C2CCNCC2)n1)Nc1cn[nH]c1
InChIInChI=1S/C16H21N5O/c22-16(21-14-10-18-19-11-14)5-4-13-2-1-3-15(20-13)12-6-8-17-9-7-12/h1-3,10-12,17H,4-9H2,(H,18,19)(H,21,22)
InChIKeyUZWNHRZRINAGEB-UHFFFAOYSA-N
XLogP1.84
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 51.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide?
The IUPAC name of 3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide (CID 95827035) is 3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide.
What is the SMILES notation for 3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide?
The canonical SMILES for 3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide is O=C(CCc1cccc(C2CCNCC2)n1)Nc1cn[nH]c1.
What is the InChIKey of 3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide?
The InChIKey is UZWNHRZRINAGEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O/c22-16(21-14-10-18-19-11-14)5-4-13-2-1-3-15(20-13)12-6-8-17-9-7-12/h1-3,10-12,17H,4-9H2,(H,18,19)(H,21,22).
What are the key properties of 3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide?
3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide has a molecular weight of 299.38 g/mol, XLogP of 1.84, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-piperidin-4-yl-2-pyridinyl)-N-(1H-pyrazol-4-yl)propanamide is sourced from PubChem (CID 95827035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).