4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide

C19H16F2N4O — CID 11256735

IUPAC4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESO=C(Nc1n[nH]c2ccccc12)N1CC=C(c2cccc(F)c2F)CC1
InChIInChI=1S/C19H16F2N4O/c20-15-6-3-5-13(17(15)21)12-8-10-25(11-9-12)19(26)22-18-14-4-1-2-7-16(14)23-24-18/h1-8H,9-11H2,(H2,22,23,24,26)
InChIKeyOCHKUUGMTLZCMV-UHFFFAOYSA-N
MW354.36 g/mol
LogP4.16
Rot. Bonds2

About 4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide

4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide (PubChem CID 11256735) has the molecular formula C19H16F2N4O and a molecular weight of 354.36 g/mol. Its IUPAC name is 4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide.

Molecular Properties

Compound Name4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide
PubChem CID11256735
Molecular FormulaC19H16F2N4O
Molecular Weight354.36 g/mol
Exact Mass354.13
IUPAC Name4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESO=C(Nc1n[nH]c2ccccc12)N1CC=C(c2cccc(F)c2F)CC1
InChIInChI=1S/C19H16F2N4O/c20-15-6-3-5-13(17(15)21)12-8-10-25(11-9-12)19(26)22-18-14-4-1-2-7-16(14)23-24-18/h1-8H,9-11H2,(H2,22,23,24,26)
InChIKeyOCHKUUGMTLZCMV-UHFFFAOYSA-N
XLogP4.16
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.36
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Linifanib
CID 11485656
N-[6-(2,5-difluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamide
CID 6539603
N-[6-(3-fluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamide
CID 6539606
1-{[4-(azepan-1-yl)-3-fluorophenyl]methyl}-3-1H-indazol-4-ylurea
CID 11338019
1-{[4-(azepan-1-yl)-3,5-difluorophenyl]methyl}-3-1H-indazol-4-ylurea
CID 16749351
N-[5-(2,3-difluorophenyl)-1H-pyrazolo[3,4-c]pyridazin-3-yl]-4-(dimethylamino)butanamide
CID 6539560
N-[6-(2-fluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamide
CID 6539602
N-[6-(4-fluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamide
CID 6539607
N-(4,5-diphenyl-1H-pyrazolo[3,4-c]pyridazin-3-yl)-N'-phenylurea
CID 6538887
1-(4,5-diphenyl-1H-pyrazolo[3,4-c]pyridazin-3-yl)-3-ethylurea
CID 6538886
N-(6-benzyl-1H-indazol-3-yl)butyramide
CID 10266409
N-(6-phenethyl-1H-indazol-3-yl)butyramide
CID 22319484

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The IUPAC name of 4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide (CID 11256735) is 4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide.
What is the SMILES notation for 4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The canonical SMILES for 4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide is O=C(Nc1n[nH]c2ccccc12)N1CC=C(c2cccc(F)c2F)CC1.
What is the InChIKey of 4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The InChIKey is OCHKUUGMTLZCMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N4O/c20-15-6-3-5-13(17(15)21)12-8-10-25(11-9-12)19(26)22-18-14-4-1-2-7-16(14)23-24-18/h1-8H,9-11H2,(H2,22,23,24,26).
What are the key properties of 4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide?
4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide has a molecular weight of 354.36 g/mol, XLogP of 4.16, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-difluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide is sourced from PubChem (CID 11256735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).