N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide

C19H21N3O2 — CID 109089256

IUPACN-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide
SMILESCC(C)(C)NC(=O)c1cc(C(=O)N2CCc3ccccc32)ccn1
InChIInChI=1S/C19H21N3O2/c1-19(2,3)21-17(23)15-12-14(8-10-20-15)18(24)22-11-9-13-6-4-5-7-16(13)22/h4-8,10,12H,9,11H2,1-3H3,(H,21,23)
InChIKeyHSSOEHNDMABTNK-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.81
Rot. Bonds2

About N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide

N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide (PubChem CID 109089256) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide
PubChem CID109089256
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC NameN-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide
SMILESCC(C)(C)NC(=O)c1cc(C(=O)N2CCc3ccccc32)ccn1
InChIInChI=1S/C19H21N3O2/c1-19(2,3)21-17(23)15-12-14(8-10-20-15)18(24)22-11-9-13-6-4-5-7-16(13)22/h4-8,10,12H,9,11H2,1-3H3,(H,21,23)
InChIKeyHSSOEHNDMABTNK-UHFFFAOYSA-N
XLogP2.81
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-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

4-(2,3-dihydroindole-1-carbonyl)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109091330
N-benzyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide
CID 109085439
[2-(3,4-dihydro-2H-quinoline-1-carbonyl)-4-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109091635
4-(2,3-dihydroindole-1-carbonyl)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
CID 109091571
4-(2,3-dihydroindole-1-carbonyl)-N-[3-(dimethylamino)propyl]pyridine-2-carboxamide
CID 109084059
4-(2,3-dihydroindole-1-carbonyl)-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 109087630
[2-(azepane-1-carbonyl)-4-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
CID 109090729
4-(2,3-dihydroindole-1-carbonyl)-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109086940
N-tert-butyl-4-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109080380
N-tert-butyl-3-(3,4-dihydro-2H-quinoline-1-carbonyl)benzamide
CID 109055995
4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide
CID 109091643
2-(2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-4-carboxamide
CID 109090812

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide?
The IUPAC name of N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide (CID 109089256) is N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide.
What is the SMILES notation for N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide?
The canonical SMILES for N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide is CC(C)(C)NC(=O)c1cc(C(=O)N2CCc3ccccc32)ccn1.
What is the InChIKey of N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide?
The InChIKey is HSSOEHNDMABTNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-19(2,3)21-17(23)15-12-14(8-10-20-15)18(24)22-11-9-13-6-4-5-7-16(13)22/h4-8,10,12H,9,11H2,1-3H3,(H,21,23).
What are the key properties of N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide?
N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide has a molecular weight of 323.40 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-4-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide is sourced from PubChem (CID 109089256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).