3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride

C18H25ClN4O — CID 119399813

IUPAC3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride
SMILESCC(CC(=O)Nc1ccc(-c2ccn[nH]2)cc1)C1CCNCC1.Cl
InChIInChI=1S/C18H24N4O.ClH/c1-13(14-6-9-19-10-7-14)12-18(23)21-16-4-2-15(3-5-16)17-8-11-20-22-17;/h2-5,8,11,13-14,19H,6-7,9-10,12H2,1H3,(H,20,22)(H,21,23);1H
InChIKeyFAUSNPBZKUOBIQ-UHFFFAOYSA-N
MW348.88 g/mol
LogP3.46
Rot. Bonds5

About 3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride

3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride (PubChem CID 119399813) has the molecular formula C18H25ClN4O and a molecular weight of 348.88 g/mol. Its IUPAC name is 3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride.

Molecular Properties

Compound Name3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride
PubChem CID119399813
Molecular FormulaC18H25ClN4O
Molecular Weight348.88 g/mol
Exact Mass348.17
IUPAC Name3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride
SMILESCC(CC(=O)Nc1ccc(-c2ccn[nH]2)cc1)C1CCNCC1.Cl
InChIInChI=1S/C18H24N4O.ClH/c1-13(14-6-9-19-10-7-14)12-18(23)21-16-4-2-15(3-5-16)17-8-11-20-22-17;/h2-5,8,11,13-14,19H,6-7,9-10,12H2,1H3,(H,20,22)(H,21,23);1H
InChIKeyFAUSNPBZKUOBIQ-UHFFFAOYSA-N
XLogP3.46
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.88
LogP ≤ 53.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-piperidin-4-yl-N-pyridin-4-ylbutanamide
CID 119827125
N-[4-(carbamoylamino)phenyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119701454
3-piperidin-4-yl-N-(4-propan-2-ylphenyl)butanamide;hydrochloride
CID 119672812
N-[4-[[2-(dimethylamino)acetyl]amino]phenyl]-3-piperidin-4-ylbutanamide;dihydrochloride
CID 119885324
3-piperidin-4-yl-N-[4-(propan-2-yloxymethyl)phenyl]butanamide;hydrochloride
CID 119742885
methyl 4-(3-piperidin-4-ylbutanoylamino)benzoate
CID 119671385
3-piperidin-4-yl-N-[4-(triazol-1-yl)phenyl]butanamide
CID 119762393
N-[4-(2-methylsulfanylethyl)phenyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119769607
3-piperidin-4-yl-N-thiophen-3-ylbutanamide;hydrochloride
CID 119788959
N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-3-piperidin-4-ylbutanamide
CID 119730157
N-ethyl-4-(3-piperidin-4-ylbutanoylamino)benzamide
CID 119714137
N-cyclopropyl-4-(3-piperidin-4-ylbutanoylamino)benzamide
CID 119698553

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride?
The IUPAC name of 3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride (CID 119399813) is 3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride.
What is the SMILES notation for 3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride?
The canonical SMILES for 3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride is CC(CC(=O)Nc1ccc(-c2ccn[nH]2)cc1)C1CCNCC1.Cl.
What is the InChIKey of 3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride?
The InChIKey is FAUSNPBZKUOBIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O.ClH/c1-13(14-6-9-19-10-7-14)12-18(23)21-16-4-2-15(3-5-16)17-8-11-20-22-17;/h2-5,8,11,13-14,19H,6-7,9-10,12H2,1H3,(H,20,22)(H,21,23);1H.
What are the key properties of 3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride?
3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride has a molecular weight of 348.88 g/mol, XLogP of 3.46, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride is sourced from PubChem (CID 119399813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).