4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide

C18H19N3O — CID 38432063

IUPAC4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide
SMILESCc1cc(C)c2cc(C(=O)N[C@H](C)c3ccccn3)[nH]c2c1
InChIInChI=1S/C18H19N3O/c1-11-8-12(2)14-10-17(21-16(14)9-11)18(22)20-13(3)15-6-4-5-7-19-15/h4-10,13,21H,1-3H3,(H,20,22)/t13-/m1/s1
InChIKeyPZHHSFFISKUIET-CYBMUJFWSA-N
MW293.37 g/mol
LogP3.67
Rot. Bonds3

About 4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide

4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide (PubChem CID 38432063) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound Name4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide
PubChem CID38432063
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide
SMILESCc1cc(C)c2cc(C(=O)N[C@H](C)c3ccccn3)[nH]c2c1
InChIInChI=1S/C18H19N3O/c1-11-8-12(2)14-10-17(21-16(14)9-11)18(22)20-13(3)15-6-4-5-7-19-15/h4-10,13,21H,1-3H3,(H,20,22)/t13-/m1/s1
InChIKeyPZHHSFFISKUIET-CYBMUJFWSA-N
XLogP3.67
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-fluoro-N-(1-pyridin-2-ylethyl)-1H-indole-2-carboxamide
CID 42947302
5-amino-N-(1-pyridin-2-ylethyl)-1H-indole-2-carboxamide
CID 63117840
4,5-dimethyl-N-[phenyl(pyridin-2-yl)methyl]-1H-indole-2-carboxamide
CID 86963672
N-(1-methoxypropan-2-yl)-4,6-dimethyl-1H-indole-2-carboxamide
CID 2823670
3-amino-4-methyl-N-(1-pyridin-2-ylethyl)benzamide
CID 43524264
4,6-dimethyl-N-[1-oxo-1-(propylamino)propan-2-yl]-1H-indole-2-carboxamide
CID 46420954
N'-(2-chlorobenzoyl)-4,6-dimethyl-1H-indole-2-carbohydrazide
CID 35932108
6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide
CID 95976232
5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)benzamide
CID 65307460
2-methyl-N-(1-pyridin-2-ylethyl)-5-sulfanylbenzamide
CID 107022791
2-(methylamino)-N-[(1R)-1-pyridin-2-ylethyl]benzamide
CID 81406697
3-methyl-N-(1-pyridin-2-ylethyl)thiophene-2-carboxamide
CID 43007029

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide?
The IUPAC name of 4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide (CID 38432063) is 4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide.
What is the SMILES notation for 4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide?
The canonical SMILES for 4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide is Cc1cc(C)c2cc(C(=O)N[C@H](C)c3ccccn3)[nH]c2c1.
What is the InChIKey of 4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide?
The InChIKey is PZHHSFFISKUIET-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H19N3O/c1-11-8-12(2)14-10-17(21-16(14)9-11)18(22)20-13(3)15-6-4-5-7-19-15/h4-10,13,21H,1-3H3,(H,20,22)/t13-/m1/s1.
What are the key properties of 4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide?
4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 3.67, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 38432063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).