2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide

C20H21N5O — CID 109363589

IUPAC2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide
SMILESCc1nc(C(=O)Nc2cccc3cccnc23)cc(N2CCCCC2)n1
InChIInChI=1S/C20H21N5O/c1-14-22-17(13-18(23-14)25-11-3-2-4-12-25)20(26)24-16-9-5-7-15-8-6-10-21-19(15)16/h5-10,13H,2-4,11-12H2,1H3,(H,24,26)
InChIKeyFXVPHSRBTQZYNN-UHFFFAOYSA-N
MW347.42 g/mol
LogP3.58
Rot. Bonds3

About 2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide

2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide (PubChem CID 109363589) has the molecular formula C20H21N5O and a molecular weight of 347.42 g/mol. Its IUPAC name is 2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide
PubChem CID109363589
Molecular FormulaC20H21N5O
Molecular Weight347.42 g/mol
Exact Mass347.17
IUPAC Name2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide
SMILESCc1nc(C(=O)Nc2cccc3cccnc23)cc(N2CCCCC2)n1
InChIInChI=1S/C20H21N5O/c1-14-22-17(13-18(23-14)25-11-3-2-4-12-25)20(26)24-16-9-5-7-15-8-6-10-21-19(15)16/h5-10,13H,2-4,11-12H2,1H3,(H,24,26)
InChIKeyFXVPHSRBTQZYNN-UHFFFAOYSA-N
XLogP3.58
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-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

2-methyl-6-pyrrolidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 109362855
6-(azepan-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide
CID 84573850
4-(azepan-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109218708
methanol;4-pyrrolidin-1-yl-N-quinolin-8-ylpyridine-2-carboxamide
CID 177001630
N-(3-chloro-2-methylphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidine-4-carboxamide
CID 109362803
6-(2,3-dihydroindol-1-yl)-2-methyl-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 112848687
6-(cycloheptylamino)-2-methyl-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 109373956
6-(azepan-1-yl)-N-(2-tert-butylphenyl)-2-methylpyrimidine-4-carboxamide
CID 112847694
6-(azepan-1-yl)-N-(2-ethylphenyl)-2-methylpyrimidine-4-carboxamide
CID 112847686
N-(2-ethylphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidine-4-carboxamide
CID 109362787
N-(2,6-difluorophenyl)-2-methyl-6-piperidin-1-ylpyrimidine-4-carboxamide
CID 109363612
N-(2,6-difluorophenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidine-4-carboxamide
CID 109362878

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide?
The IUPAC name of 2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide (CID 109363589) is 2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide.
What is the SMILES notation for 2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide?
The canonical SMILES for 2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide is Cc1nc(C(=O)Nc2cccc3cccnc23)cc(N2CCCCC2)n1.
What is the InChIKey of 2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide?
The InChIKey is FXVPHSRBTQZYNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O/c1-14-22-17(13-18(23-14)25-11-3-2-4-12-25)20(26)24-16-9-5-7-15-8-6-10-21-19(15)16/h5-10,13H,2-4,11-12H2,1H3,(H,24,26).
What are the key properties of 2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide?
2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide has a molecular weight of 347.42 g/mol, XLogP of 3.58, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-piperidin-1-yl-N-quinolin-8-ylpyrimidine-4-carboxamide is sourced from PubChem (CID 109363589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).