1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide

C17H28N4O — CID 119441384

IUPAC1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide
SMILESCN(C(=O)c1cc(C2CC2)n(C(C)(C)C)n1)C1CCNCC1
InChIInChI=1S/C17H28N4O/c1-17(2,3)21-15(12-5-6-12)11-14(19-21)16(22)20(4)13-7-9-18-10-8-13/h11-13,18H,5-10H2,1-4H3
InChIKeyLAUFZDKPCYLJJJ-UHFFFAOYSA-N
MW304.44 g/mol
LogP2.34
Rot. Bonds3

About 1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide

1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide (PubChem CID 119441384) has the molecular formula C17H28N4O and a molecular weight of 304.44 g/mol. Its IUPAC name is 1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide.

Molecular Properties

Compound Name1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide
PubChem CID119441384
Molecular FormulaC17H28N4O
Molecular Weight304.44 g/mol
Exact Mass304.23
IUPAC Name1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide
SMILESCN(C(=O)c1cc(C2CC2)n(C(C)(C)C)n1)C1CCNCC1
InChIInChI=1S/C17H28N4O/c1-17(2,3)21-15(12-5-6-12)11-14(19-21)16(22)20(4)13-7-9-18-10-8-13/h11-13,18H,5-10H2,1-4H3
InChIKeyLAUFZDKPCYLJJJ-UHFFFAOYSA-N
XLogP2.34
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.44
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-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

N-(2-amino-2-oxoethyl)-1-tert-butyl-N-cyclopentyl-5-cyclopropylpyrazole-3-carboxamide
CID 56817946
1-tert-butyl-5-cyclopropyl-N-[1-(2,5-difluorophenyl)ethyl]-N-methylpyrazole-3-carboxamide
CID 87015995
(1-tert-butyl-5-cyclopropylpyrazol-3-yl)-(3-piperazin-1-ylpyrrolidin-1-yl)methanone
CID 120995335
N,1-dimethyl-N-piperidin-4-ylpyrazole-3-carboxamide
CID 103120629
1-tert-butyl-5-cyclopropyl-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]pyrazole-3-carboxamide
CID 120889149
(1-tert-butyl-5-cyclopropylpyrazol-3-yl)-[(3S,4R)-3-(dimethylamino)-4-ethylpyrrolidin-1-yl]methanone
CID 97096989
N,5-dimethyl-N-piperidin-4-ylpyrazine-2-carboxamide
CID 43602095
N-(8-azabicyclo[3.2.1]octan-3-yl)-1-tert-butyl-5-cyclopropylpyrazole-3-carboxamide
CID 119455407
N-(4-aminocyclohexyl)-1-tert-butyl-5-cyclopropylpyrazole-3-carboxamide
CID 119474690
3-ethyl-N,1-dimethyl-N-piperidin-4-ylpyrazole-5-carboxamide
CID 66121344
N-(azepan-4-yl)-N,1-dimethylimidazole-4-carboxamide
CID 114022842
1-tert-butyl-5-cyclopropyl-N-(2-methylpiperidin-3-yl)pyrazole-3-carboxamide;hydrochloride
CID 120577098

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide?
The IUPAC name of 1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide (CID 119441384) is 1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide.
What is the SMILES notation for 1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide?
The canonical SMILES for 1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide is CN(C(=O)c1cc(C2CC2)n(C(C)(C)C)n1)C1CCNCC1.
What is the InChIKey of 1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide?
The InChIKey is LAUFZDKPCYLJJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O/c1-17(2,3)21-15(12-5-6-12)11-14(19-21)16(22)20(4)13-7-9-18-10-8-13/h11-13,18H,5-10H2,1-4H3.
What are the key properties of 1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide?
1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide has a molecular weight of 304.44 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-5-cyclopropyl-N-methyl-N-piperidin-4-ylpyrazole-3-carboxamide is sourced from PubChem (CID 119441384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).