N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide

C19H16FN5O2 — CID 163784998

IUPACN-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide
SMILESO=C(Nc1cn[nH]c1C(=O)Nc1ccc(F)cc1)c1c[nH]c2c1C=CCC2
InChIInChI=1S/C19H16FN5O2/c20-11-5-7-12(8-6-11)23-19(27)17-16(10-22-25-17)24-18(26)14-9-21-15-4-2-1-3-13(14)15/h1,3,5-10,21H,2,4H2,(H,22,25)(H,23,27)(H,24,26)
InChIKeyMRTYTRIMNZKVCC-UHFFFAOYSA-N
MW365.37 g/mol
LogP3.34
Rot. Bonds4

About N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide

N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide (PubChem CID 163784998) has the molecular formula C19H16FN5O2 and a molecular weight of 365.37 g/mol. Its IUPAC name is N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide
PubChem CID163784998
Molecular FormulaC19H16FN5O2
Molecular Weight365.37 g/mol
Exact Mass365.13
IUPAC NameN-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide
SMILESO=C(Nc1cn[nH]c1C(=O)Nc1ccc(F)cc1)c1c[nH]c2c1C=CCC2
InChIInChI=1S/C19H16FN5O2/c20-11-5-7-12(8-6-11)23-19(27)17-16(10-22-25-17)24-18(26)14-9-21-15-4-2-1-3-13(14)15/h1,3,5-10,21H,2,4H2,(H,22,25)(H,23,27)(H,24,26)
InChIKeyMRTYTRIMNZKVCC-UHFFFAOYSA-N
XLogP3.34
TPSA102.67 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.37
LogP ≤ 53.34
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-2-carboxamide
CID 59733537
4-[(2,6-difluorobenzoyl)amino]-N-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 24864079
N-(4-fluorophenyl)-4-(methanesulfonamido)-1H-pyrazole-5-carboxamide
CID 59733321
N-(4-fluorophenyl)-4-[(3-nitrobenzoyl)amino]-1H-pyrazole-5-carboxamide
CID 59733390
4-amino-N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-1-methylimidazole-2-carboxamide
CID 59733306
N-(6-chloro-3-pyridinyl)-4-[(2,4-dichlorobenzoyl)amino]-1H-pyrazole-5-carboxamide
CID 141152111
N-(4-fluorophenyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 60757361
N-cyclopentyl-4-[(2,4-difluorobenzoyl)amino]-1H-pyrazole-5-carboxamide
CID 69378336
4-[(2,4-difluorobenzoyl)amino]-N-propan-2-yl-1H-pyrazole-5-carboxamide
CID 69378981
N-(4-fluorophenyl)-6-oxo-1H-pyridazine-5-carboxamide
CID 69229250
4-amino-N-(4-fluoro-2-iodophenyl)-1H-pyrazole-5-carboxamide
CID 79768952
N-[4-[2-(2-aminoanilino)-2-oxoethyl]phenyl]-4-[(2,6-difluorobenzoyl)amino]-1H-pyrazole-5-carboxamide
CID 162658849

Frequently Asked Questions

What is the IUPAC name of N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide?
The IUPAC name of N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide (CID 163784998) is N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide.
What is the SMILES notation for N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide?
The canonical SMILES for N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide is O=C(Nc1cn[nH]c1C(=O)Nc1ccc(F)cc1)c1c[nH]c2c1C=CCC2.
What is the InChIKey of N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide?
The InChIKey is MRTYTRIMNZKVCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN5O2/c20-11-5-7-12(8-6-11)23-19(27)17-16(10-22-25-17)24-18(26)14-9-21-15-4-2-1-3-13(14)15/h1,3,5-10,21H,2,4H2,(H,22,25)(H,23,27)(H,24,26).
What are the key properties of N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide?
N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide has a molecular weight of 365.37 g/mol, XLogP of 3.34, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(4-fluorophenyl)carbamoyl]-1H-pyrazol-4-yl]-6,7-dihydro-1H-indole-3-carboxamide is sourced from PubChem (CID 163784998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).