N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide

C22H27N3O — CID 84574692

IUPACN-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
SMILESCC1Cc2ccccc2N1c1ncccc1C(=O)NC1CCCCCC1
InChIInChI=1S/C22H27N3O/c1-16-15-17-9-6-7-13-20(17)25(16)21-19(12-8-14-23-21)22(26)24-18-10-4-2-3-5-11-18/h6-9,12-14,16,18H,2-5,10-11,15H2,1H3,(H,24,26)
InChIKeyXWVFHCUJBIGJSU-UHFFFAOYSA-N
MW349.48 g/mol
LogP4.62
Rot. Bonds3

About N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide

N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide (PubChem CID 84574692) has the molecular formula C22H27N3O and a molecular weight of 349.48 g/mol. Its IUPAC name is N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
PubChem CID84574692
Molecular FormulaC22H27N3O
Molecular Weight349.48 g/mol
Exact Mass349.22
IUPAC NameN-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
SMILESCC1Cc2ccccc2N1c1ncccc1C(=O)NC1CCCCCC1
InChIInChI=1S/C22H27N3O/c1-16-15-17-9-6-7-13-20(17)25(16)21-19(12-8-14-23-21)22(26)24-18-10-4-2-3-5-11-18/h6-9,12-14,16,18H,2-5,10-11,15H2,1H3,(H,24,26)
InChIKeyXWVFHCUJBIGJSU-UHFFFAOYSA-N
XLogP4.62
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.48
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84574698
[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]-(2-methylpiperidin-1-yl)methanone
CID 84574657
N-(4-fluorophenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84574636
N-[3-(dimethylamino)propyl]-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84574658
N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84574667
N-cycloheptyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyridazine-3-carboxamide
CID 109125067
N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
CID 109287538
N-cyclopropyl-2-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84576404
(4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone
CID 84574669
N-cyclopentyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridine-3-carboxamide
CID 84574711
(2S)-N-cyclooctyl-2-methyl-2,3-dihydroindole-1-carboxamide
CID 67191919
N-cyclohexyl-2-methylpyridine-3-carboxamide
CID 78951017

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide (CID 84574692) is N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide is CC1Cc2ccccc2N1c1ncccc1C(=O)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
The InChIKey is XWVFHCUJBIGJSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O/c1-16-15-17-9-6-7-13-20(17)25(16)21-19(12-8-14-23-21)22(26)24-18-10-4-2-3-5-11-18/h6-9,12-14,16,18H,2-5,10-11,15H2,1H3,(H,24,26).
What are the key properties of N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide has a molecular weight of 349.48 g/mol, XLogP of 4.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 84574692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).