1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide

C25H22N4O — CID 8001480

IUPAC1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide
SMILESO=C(N[C@@H]1CCCc2ccccc21)c1cn(-c2ccccc2)nc1-c1cccnc1
InChIInChI=1S/C25H22N4O/c30-25(27-23-14-6-9-18-8-4-5-13-21(18)23)22-17-29(20-11-2-1-3-12-20)28-24(22)19-10-7-15-26-16-19/h1-5,7-8,10-13,15-17,23H,6,9,14H2,(H,27,30)/t23-/m1/s1
InChIKeyDRJJGCNYFHYKRI-HSZRJFAPSA-N
MW394.48 g/mol
LogP4.74
Rot. Bonds4

About 1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide

1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide (PubChem CID 8001480) has the molecular formula C25H22N4O and a molecular weight of 394.48 g/mol. Its IUPAC name is 1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide
PubChem CID8001480
Molecular FormulaC25H22N4O
Molecular Weight394.48 g/mol
Exact Mass394.18
IUPAC Name1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide
SMILESO=C(N[C@@H]1CCCc2ccccc21)c1cn(-c2ccccc2)nc1-c1cccnc1
InChIInChI=1S/C25H22N4O/c30-25(27-23-14-6-9-18-8-4-5-13-21(18)23)22-17-29(20-11-2-1-3-12-20)28-24(22)19-10-7-15-26-16-19/h1-5,7-8,10-13,15-17,23H,6,9,14H2,(H,27,30)/t23-/m1/s1
InChIKeyDRJJGCNYFHYKRI-HSZRJFAPSA-N
XLogP4.74
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.48
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 9208931
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CID 71892750
N-[(3S)-2-oxoazepan-3-yl]-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 94133021
N-cycloheptyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
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N-[4-chloro-3-(cyclohexylcarbamoyl)phenyl]-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 55906395
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CID 883433
N-[4-(cyclopentylmethylamino)phenyl]-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 56533831
N-(2-oxo-2-pyrrolidin-1-ylethyl)-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 24612015
(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methanone
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1-phenyl-N-(piperidin-3-ylmethyl)-3-pyridin-3-ylpyrazole-4-carboxamide;dihydrochloride
CID 119459838
N'-(4-hydroxy-1-phenylpyrazole-3-carbonyl)-1-phenyl-3-pyridin-3-ylpyrazole-4-carbohydrazide
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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide?
The IUPAC name of 1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide (CID 8001480) is 1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide.
What is the SMILES notation for 1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide?
The canonical SMILES for 1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide is O=C(N[C@@H]1CCCc2ccccc21)c1cn(-c2ccccc2)nc1-c1cccnc1.
What is the InChIKey of 1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide?
The InChIKey is DRJJGCNYFHYKRI-HSZRJFAPSA-N. The full InChI is InChI=1S/C25H22N4O/c30-25(27-23-14-6-9-18-8-4-5-13-21(18)23)22-17-29(20-11-2-1-3-12-20)28-24(22)19-10-7-15-26-16-19/h1-5,7-8,10-13,15-17,23H,6,9,14H2,(H,27,30)/t23-/m1/s1.
What are the key properties of 1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide?
1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide has a molecular weight of 394.48 g/mol, XLogP of 4.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide is sourced from PubChem (CID 8001480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).