N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide

C24H27N5O — CID 95216572

IUPACN-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide
SMILESCc1ccc(-c2cn[nH]c2[C@@H]2CCCN(c3cc(C(=O)NC4CC4)ccn3)C2)cc1
InChIInChI=1S/C24H27N5O/c1-16-4-6-17(7-5-16)21-14-26-28-23(21)19-3-2-12-29(15-19)22-13-18(10-11-25-22)24(30)27-20-8-9-20/h4-7,10-11,13-14,19-20H,2-3,8-9,12,15H2,1H3,(H,26,28)(H,27,30)/t19-/m1/s1
InChIKeyUEGANBUHGSNIIR-LJQANCHMSA-N
MW401.51 g/mol
LogP4.06
Rot. Bonds5

About N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide

N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide (PubChem CID 95216572) has the molecular formula C24H27N5O and a molecular weight of 401.51 g/mol. Its IUPAC name is N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide
PubChem CID95216572
Molecular FormulaC24H27N5O
Molecular Weight401.51 g/mol
Exact Mass401.22
IUPAC NameN-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide
SMILESCc1ccc(-c2cn[nH]c2[C@@H]2CCCN(c3cc(C(=O)NC4CC4)ccn3)C2)cc1
InChIInChI=1S/C24H27N5O/c1-16-4-6-17(7-5-16)21-14-26-28-23(21)19-3-2-12-29(15-19)22-13-18(10-11-25-22)24(30)27-20-8-9-20/h4-7,10-11,13-14,19-20H,2-3,8-9,12,15H2,1H3,(H,26,28)(H,27,30)/t19-/m1/s1
InChIKeyUEGANBUHGSNIIR-LJQANCHMSA-N
XLogP4.06
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.51
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-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

2-[(3S)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide
CID 95225385
[3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]-pyridin-4-ylmethanone
CID 56748606
2-[(3S)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-3-carboxylic acid
CID 95223986
2-[(3S)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyrimidin-4-amine
CID 95197091
(2-cyclopropylpyrimidin-5-yl)-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]methanone
CID 95223415
[3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 56741838
N-[3-[3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]-3-oxopropyl]acetamide
CID 70731856
2-hydroxy-2-methyl-1-[3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]propan-1-one
CID 56746262
5-[(3S)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidine-1-carbonyl]pyridine-2-carbonitrile
CID 95188082
2-amino-2-methyl-1-[(3S)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]propan-1-one
CID 95196951
(5-hydroxy-2-pyridinyl)-[3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]methanone
CID 56740484
[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]-(1-propan-2-ylpyrazol-4-yl)methanone
CID 95211783

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide?
The IUPAC name of N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide (CID 95216572) is N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide?
The canonical SMILES for N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide is Cc1ccc(-c2cn[nH]c2[C@@H]2CCCN(c3cc(C(=O)NC4CC4)ccn3)C2)cc1.
What is the InChIKey of N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide?
The InChIKey is UEGANBUHGSNIIR-LJQANCHMSA-N. The full InChI is InChI=1S/C24H27N5O/c1-16-4-6-17(7-5-16)21-14-26-28-23(21)19-3-2-12-29(15-19)22-13-18(10-11-25-22)24(30)27-20-8-9-20/h4-7,10-11,13-14,19-20H,2-3,8-9,12,15H2,1H3,(H,26,28)(H,27,30)/t19-/m1/s1.
What are the key properties of N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide?
N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide has a molecular weight of 401.51 g/mol, XLogP of 4.06, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(3R)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]pyridine-4-carboxamide is sourced from PubChem (CID 95216572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).