N-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide

C20H23N3O — CID 84574195

IUPACN-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
SMILESO=C(NC1CCCCC1)c1cccc(N2CCc3ccccc32)n1
InChIInChI=1S/C20H23N3O/c24-20(21-16-8-2-1-3-9-16)17-10-6-12-19(22-17)23-14-13-15-7-4-5-11-18(15)23/h4-7,10-12,16H,1-3,8-9,13-14H2,(H,21,24)
InChIKeyHSBFRKLOIWJKDU-UHFFFAOYSA-N
MW321.42 g/mol
LogP3.84
Rot. Bonds3

About N-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide

N-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide (PubChem CID 84574195) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is N-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
PubChem CID84574195
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC NameN-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
SMILESO=C(NC1CCCCC1)c1cccc(N2CCc3ccccc32)n1
InChIInChI=1S/C20H23N3O/c24-20(21-16-8-2-1-3-9-16)17-10-6-12-19(22-17)23-14-13-15-7-4-5-11-18(15)23/h4-7,10-12,16H,1-3,8-9,13-14H2,(H,21,24)
InChIKeyHSBFRKLOIWJKDU-UHFFFAOYSA-N
XLogP3.84
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The IUPAC name of N-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide (CID 84574195) is N-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide is O=C(NC1CCCCC1)c1cccc(N2CCc3ccccc32)n1.
What is the InChIKey of N-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The InChIKey is HSBFRKLOIWJKDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O/c24-20(21-16-8-2-1-3-9-16)17-10-6-12-19(22-17)23-14-13-15-7-4-5-11-18(15)23/h4-7,10-12,16H,1-3,8-9,13-14H2,(H,21,24).
What are the key properties of N-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
N-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide has a molecular weight of 321.42 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide is sourced from PubChem (CID 84574195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).