4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide

C23H22N4O — CID 138674503

IUPAC4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide
SMILESCc1cc2[nH]ncc2cc1-c1ccc(CCCC(=O)Nc2cccnc2)cc1
InChIInChI=1S/C23H22N4O/c1-16-12-22-19(14-25-27-22)13-21(16)18-9-7-17(8-10-18)4-2-6-23(28)26-20-5-3-11-24-15-20/h3,5,7-15H,2,4,6H2,1H3,(H,25,27)(H,26,28)
InChIKeyXRIMEVFRCHCOIV-UHFFFAOYSA-N
MW370.46 g/mol
LogP4.89
Rot. Bonds6

About 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide

4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide (PubChem CID 138674503) has the molecular formula C23H22N4O and a molecular weight of 370.46 g/mol. Its IUPAC name is 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide.

Molecular Properties

Compound Name4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide
PubChem CID138674503
Molecular FormulaC23H22N4O
Molecular Weight370.46 g/mol
Exact Mass370.18
IUPAC Name4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide
SMILESCc1cc2[nH]ncc2cc1-c1ccc(CCCC(=O)Nc2cccnc2)cc1
InChIInChI=1S/C23H22N4O/c1-16-12-22-19(14-25-27-22)13-21(16)18-9-7-17(8-10-18)4-2-6-23(28)26-20-5-3-11-24-15-20/h3,5,7-15H,2,4,6H2,1H3,(H,25,27)(H,26,28)
InChIKeyXRIMEVFRCHCOIV-UHFFFAOYSA-N
XLogP4.89
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.46
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[4-(2-fluorophenyl)phenyl]-N-pyridin-3-ylbutanamide
CID 138674351
4-[4-(2-methylquinolin-6-yl)phenyl]-N-pyridin-3-ylbutanamide
CID 138674422
4-[4-(1-methylindazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide
CID 138674494
4-[4-(4-amino-3-methanimidoyl-2-methylphenyl)phenyl]-N-pyridin-3-ylbutanamide
CID 164706505
5-(4-bromophenyl)-N-pyridin-3-ylpentanamide
CID 166191110
N-(1H-indazol-6-yl)-3-(4-methylphenyl)propanamide
CID 36563064
N-pyridin-3-yl-4-[4-[6-(trifluoromethyl)-3-pyridinyl]phenyl]butanamide
CID 138674390
4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide
CID 138674485
2-(4-methylphenyl)-N-pyridin-3-ylacetamide
CID 890802
4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide
CID 164964850
4-hydroxy-N-(1H-indazol-5-yl)butanamide
CID 79200157
2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide
CID 177434462

Frequently Asked Questions

What is the IUPAC name of 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide?
The IUPAC name of 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide (CID 138674503) is 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide.
What is the SMILES notation for 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide?
The canonical SMILES for 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide is Cc1cc2[nH]ncc2cc1-c1ccc(CCCC(=O)Nc2cccnc2)cc1.
What is the InChIKey of 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide?
The InChIKey is XRIMEVFRCHCOIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O/c1-16-12-22-19(14-25-27-22)13-21(16)18-9-7-17(8-10-18)4-2-6-23(28)26-20-5-3-11-24-15-20/h3,5,7-15H,2,4,6H2,1H3,(H,25,27)(H,26,28).
What are the key properties of 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide?
4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide has a molecular weight of 370.46 g/mol, XLogP of 4.89, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide is sourced from PubChem (CID 138674503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).