N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide

C18H19N3O2 — CID 110790308

IUPACN-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide
SMILESCC1(C)C(=O)Nc2ccc(CCNC(=O)c3cccnc3)cc21
InChIInChI=1S/C18H19N3O2/c1-18(2)14-10-12(5-6-15(14)21-17(18)23)7-9-20-16(22)13-4-3-8-19-11-13/h3-6,8,10-11H,7,9H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyKWQNQQPNWYIULS-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.28
Rot. Bonds4

About N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide

N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide (PubChem CID 110790308) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide
PubChem CID110790308
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide
SMILESCC1(C)C(=O)Nc2ccc(CCNC(=O)c3cccnc3)cc21
InChIInChI=1S/C18H19N3O2/c1-18(2)14-10-12(5-6-15(14)21-17(18)23)7-9-20-16(22)13-4-3-8-19-11-13/h3-6,8,10-11H,7,9H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyKWQNQQPNWYIULS-UHFFFAOYSA-N
XLogP2.28
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(3,4-difluorophenyl)ethyl]pyridine-3-carboxamide
CID 110788258
N-[2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]pyridine-3-carboxamide
CID 110789922
N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide;hydrochloride
CID 110755852
N-[2-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)ethyl]pyridine-3-carboxamide
CID 110792165
N-[2-(4-nitrophenyl)ethyl]pyridine-3-carboxamide
CID 110294457
N-[2-(1,3-benzodioxol-5-yl)ethyl]pyridine-3-carboxamide
CID 861830
N-[2-(1H-pyrrol-3-yl)ethyl]pyridine-3-carboxamide;hydrochloride
CID 110789365
N-[2-(2-hydroxyphenyl)ethyl]pyridine-3-carboxamide
CID 67172955
N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]pyridine-3-carboxamide;hydrochloride
CID 110787889
6,6-dimethyl-5-oxo-N-[2-(pyridine-3-carbonylamino)ethyl]thiomorpholine-3-carboxamide
CID 74245475
3-N-[2-(4-fluorophenyl)ethyl]-5-N-(pyridin-3-ylmethyl)pyridine-3,5-dicarboxamide
CID 109105993
N-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]pyridine-3-carboxamide
CID 112994012

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide?
The IUPAC name of N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide (CID 110790308) is N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide is CC1(C)C(=O)Nc2ccc(CCNC(=O)c3cccnc3)cc21.
What is the InChIKey of N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide?
The InChIKey is KWQNQQPNWYIULS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-18(2)14-10-12(5-6-15(14)21-17(18)23)7-9-20-16(22)13-4-3-8-19-11-13/h3-6,8,10-11H,7,9H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide?
N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 110790308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).