N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide

C19H22N6O — CID 46993346

IUPACN-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide
SMILESCCC(CC)n1nc(C)cc1NC(=O)c1cnc(-c2cccnc2)nc1
InChIInChI=1S/C19H22N6O/c1-4-16(5-2)25-17(9-13(3)24-25)23-19(26)15-11-21-18(22-12-15)14-7-6-8-20-10-14/h6-12,16H,4-5H2,1-3H3,(H,23,26)
InChIKeyYWEKXZWGRQSDAC-UHFFFAOYSA-N
MW350.43 g/mol
LogP3.66
Rot. Bonds6

About N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide

N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide (PubChem CID 46993346) has the molecular formula C19H22N6O and a molecular weight of 350.43 g/mol. Its IUPAC name is N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide
PubChem CID46993346
Molecular FormulaC19H22N6O
Molecular Weight350.43 g/mol
Exact Mass350.19
IUPAC NameN-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide
SMILESCCC(CC)n1nc(C)cc1NC(=O)c1cnc(-c2cccnc2)nc1
InChIInChI=1S/C19H22N6O/c1-4-16(5-2)25-17(9-13(3)24-25)23-19(26)15-11-21-18(22-12-15)14-7-6-8-20-10-14/h6-12,16H,4-5H2,1-3H3,(H,23,26)
InChIKeyYWEKXZWGRQSDAC-UHFFFAOYSA-N
XLogP3.66
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.43
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide
CID 50952644
3-chloro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide
CID 46992442
N-[1-(2,4-dimethylphenyl)propyl]-2-pyridin-3-ylpyrimidine-5-carboxamide
CID 72936682
N-[(1R)-1-(2,4-dimethylphenyl)propyl]-2-pyridin-3-ylpyrimidine-5-carboxamide
CID 97209971
N-[(1R)-1-(2-methylpyrazol-3-yl)propyl]-2-pyridin-3-ylpyrimidine-5-carboxamide
CID 97203575
3-acetamido-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)thiophene-2-carboxamide
CID 50960014
N-ethyl-6-pyridin-3-ylpyridine-3-carboxamide
CID 141194620
(2S)-2-acetamido-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)propanamide
CID 46999276
N-[2-[(2,4-dichlorophenyl)methyl]-5-methylpyrazol-3-yl]pyridine-3-carboxamide
CID 5302832
N-[1-(3-ethyl-1,2,4-oxadiazol-5-yl)ethyl]-2-pyridin-3-ylpyrimidine-5-carboxamide
CID 56743859
N-(2-butan-2-yl-5-methylpyrazol-3-yl)-5-phenyl-1,2-oxazole-4-carboxamide
CID 134709378
4-fluoro-N-(2-pyridin-3-ylpyrimidin-5-yl)benzamide
CID 137419125

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide?
The IUPAC name of N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide (CID 46993346) is N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide.
What is the SMILES notation for N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide?
The canonical SMILES for N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide is CCC(CC)n1nc(C)cc1NC(=O)c1cnc(-c2cccnc2)nc1.
What is the InChIKey of N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide?
The InChIKey is YWEKXZWGRQSDAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O/c1-4-16(5-2)25-17(9-13(3)24-25)23-19(26)15-11-21-18(22-12-15)14-7-6-8-20-10-14/h6-12,16H,4-5H2,1-3H3,(H,23,26).
What are the key properties of N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide?
N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide has a molecular weight of 350.43 g/mol, XLogP of 3.66, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide is sourced from PubChem (CID 46993346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).