N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide

C18H24N4O2 — CID 155566254

IUPACN-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide
SMILESCOc1ccc(-c2ccn(CCNC(=O)N3CCCCC3)n2)cc1
InChIInChI=1S/C18H24N4O2/c1-24-16-7-5-15(6-8-16)17-9-13-22(20-17)14-10-19-18(23)21-11-3-2-4-12-21/h5-9,13H,2-4,10-12,14H2,1H3,(H,19,23)
InChIKeyJALYYFLGNMWELW-UHFFFAOYSA-N
MW328.42 g/mol
LogP2.75
Rot. Bonds5

About N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide

N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide (PubChem CID 155566254) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide
PubChem CID155566254
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC NameN-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide
SMILESCOc1ccc(-c2ccn(CCNC(=O)N3CCCCC3)n2)cc1
InChIInChI=1S/C18H24N4O2/c1-24-16-7-5-15(6-8-16)17-9-13-22(20-17)14-10-19-18(23)21-11-3-2-4-12-21/h5-9,13H,2-4,10-12,14H2,1H3,(H,19,23)
InChIKeyJALYYFLGNMWELW-UHFFFAOYSA-N
XLogP2.75
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide 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

1-(4-methoxyphenyl)-3-(3-(1-methyl-1H-pyrazol-5-yl)-4-(2-(piperidin-1-yl)ethoxy)phenyl)urea
CID 45486657
N-{[1-methyl-3-(4-phenoxyphenyl)-1H-pyrazol-4-yl]methyl}-1-propylpiperidin-4-amine
CID 16190345
1-[3-(2-fluoro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(3-pyridinylmethyl)methanamine
CID 16189779
3-[4-(4-Fluoro-phenoxy)-phenyl]-pyrazole-1-carboxylic acid amide
CID 9861009
3-[4-(2,4-Difluoro-phenoxy)-phenyl]-pyrazole-1-carboxylic acid amide
CID 9948785
3-[4-(4-Fluoro-phenoxy)-phenyl]-pyrazole-1-carboxylic acid dimethylamide
CID 11198140
3-(4-Phenoxy-phenyl)-pyrazole-1-carboxylic acid amide
CID 11300443
1-(3-(1-methyl-1H-pyrazol-5-yl)-4-(2-(piperidin-1-yl)ethoxy)phenyl)-3-phenylurea
CID 45486737
1-[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]piperazine
CID 117209971
[4-[(4-Phenylmethoxyphenyl)methyl]piperazin-1-yl]-pyrazol-1-ylmethanone
CID 118526625
(4-Methylpyrazol-1-yl)-[4-[(4-phenylmethoxyphenyl)methyl]piperazin-1-yl]methanone
CID 118526627
[4-[(4-Phenoxyphenyl)methyl]piperazin-1-yl]-pyrazol-1-ylmethanone
CID 118526657

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide?
The IUPAC name of N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide (CID 155566254) is N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide.
What is the SMILES notation for N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide?
The canonical SMILES for N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide is COc1ccc(-c2ccn(CCNC(=O)N3CCCCC3)n2)cc1.
What is the InChIKey of N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide?
The InChIKey is JALYYFLGNMWELW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-24-16-7-5-15(6-8-16)17-9-13-22(20-17)14-10-19-18(23)21-11-3-2-4-12-21/h5-9,13H,2-4,10-12,14H2,1H3,(H,19,23).
What are the key properties of N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide?
N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 155566254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).