N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide

C18H15N5O — CID 25099397

IUPACN-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide
SMILESO=C(NN1CCc2ccccc21)c1cnc(-c2ccccn2)nc1
InChIInChI=1S/C18H15N5O/c24-18(22-23-10-8-13-5-1-2-7-16(13)23)14-11-20-17(21-12-14)15-6-3-4-9-19-15/h1-7,9,11-12H,8,10H2,(H,22,24)
InChIKeyLLBGXZQZOLKABY-UHFFFAOYSA-N
MW317.35 g/mol
LogP2.25
Rot. Bonds3

About N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide

N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide (PubChem CID 25099397) has the molecular formula C18H15N5O and a molecular weight of 317.35 g/mol. Its IUPAC name is N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide
PubChem CID25099397
Molecular FormulaC18H15N5O
Molecular Weight317.35 g/mol
Exact Mass317.13
IUPAC NameN-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide
SMILESO=C(NN1CCc2ccccc21)c1cnc(-c2ccccn2)nc1
InChIInChI=1S/C18H15N5O/c24-18(22-23-10-8-13-5-1-2-7-16(13)23)14-11-20-17(21-12-14)15-6-3-4-9-19-15/h1-7,9,11-12H,8,10H2,(H,22,24)
InChIKeyLLBGXZQZOLKABY-UHFFFAOYSA-N
XLogP2.25
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-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

5-PyriMidinecarboxaMide, N-(5-fluoro-3-Methyl-1H-indol-1-yl)-4-Methyl-2-(2-pyridinyl)-
CID 25099474
CU-CPT-8m
CID 15042086
2-((4,6-Dimethylpyridin-2-yl)amino)-N-(2-(2-methyl-1H-indol-3-yl)ethyl)pyrimidine-5-carboxamide
CID 145996528
2-(4-Hydroxy-phenyl)-2,5,6,7,8,9-hexahydro-pyrazolo[4,3-c]quinolin-3-one
CID 13713270
N-phenyl-6-(pyrid-2-yl)imidazo[1,2-a]pyridine-2-carboxamide
CID 68779277
7-(difluoromethyl)-N-morpholin-4-yl-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 995380
4-Methyl-2-pyridin-2-yl-pyrimidine-5-carboxylic acid (5-fluoro-3-methyl-pyrrolo[3,2-b]pyridin-1-yl)-amide
CID 59200016
2-anilino-N-[2-(2-methylindol-1-yl)ethyl]pyrimidine-5-carboxamide
CID 90680605
1-(7,7-Difluoro-5,6-dihydrocyclopenta[b]pyridin-2-yl)-6-[4-(4-methylpiperazin-1-yl)anilino]-2-prop-2-enylpyrazolo[3,4-d]pyrimidin-3-one
CID 139482672
N-[2-(2-methyl-1H-indol-3-yl)ethyl]-2-[(6-methyl-2-pyridinyl)amino]pyrimidine-5-carboxamide
CID 155128758
N-[2-(2-methyl-1H-indol-3-yl)ethyl]-2-[(4-methyl-2-pyridinyl)amino]pyrimidine-5-carboxamide
CID 155128761
N-[2-(2-methyl-1H-indol-3-yl)ethyl]-2-(pyridin-2-ylamino)pyrimidine-5-carboxamide
CID 155128769

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide?
The IUPAC name of N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide (CID 25099397) is N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide.
What is the SMILES notation for N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide?
The canonical SMILES for N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide is O=C(NN1CCc2ccccc21)c1cnc(-c2ccccn2)nc1.
What is the InChIKey of N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide?
The InChIKey is LLBGXZQZOLKABY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O/c24-18(22-23-10-8-13-5-1-2-7-16(13)23)14-11-20-17(21-12-14)15-6-3-4-9-19-15/h1-7,9,11-12H,8,10H2,(H,22,24).
What are the key properties of N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide?
N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide has a molecular weight of 317.35 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydroindol-1-yl)-2-pyridin-2-ylpyrimidine-5-carboxamide is sourced from PubChem (CID 25099397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).