N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide

C22H26N6O2 — CID 167845050

IUPACN-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide
SMILESCNC(=O)c1ccc(N2CCN([C@@H](C)C3=CC4=NC(=O)C(C)=CC4N=C3)CC2)cn1
InChIInChI=1S/C22H26N6O2/c1-14-10-19-20(26-21(14)29)11-16(12-24-19)15(2)27-6-8-28(9-7-27)17-4-5-18(25-13-17)22(30)23-3/h4-5,10-13,15,19H,6-9H2,1-3H3,(H,23,30)/t15-,19?/m0/s1
InChIKeyARYKAXXCFIDCEN-FUKCDUGKSA-N
MW406.49 g/mol
LogP1.26
Rot. Bonds4

About N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide

N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide (PubChem CID 167845050) has the molecular formula C22H26N6O2 and a molecular weight of 406.49 g/mol. Its IUPAC name is N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide
PubChem CID167845050
Molecular FormulaC22H26N6O2
Molecular Weight406.49 g/mol
Exact Mass406.21
IUPAC NameN-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide
SMILESCNC(=O)c1ccc(N2CCN([C@@H](C)C3=CC4=NC(=O)C(C)=CC4N=C3)CC2)cn1
InChIInChI=1S/C22H26N6O2/c1-14-10-19-20(26-21(14)29)11-16(12-24-19)15(2)27-6-8-28(9-7-27)17-4-5-18(25-13-17)22(30)23-3/h4-5,10-13,15,19H,6-9H2,1-3H3,(H,23,30)/t15-,19?/m0/s1
InChIKeyARYKAXXCFIDCEN-FUKCDUGKSA-N
XLogP1.26
TPSA90.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.49
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]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

N-cyclopropyl-5-[4-[(1R)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide
CID 167845053
5-[4-[(7-ethyl-6-oxo-8aH-1,5-naphthyridin-3-yl)methyl]piperazin-1-yl]-N-propan-2-ylpyridine-2-carboxamide
CID 167844988
5-[4-[(7-ethyl-6-oxo-8aH-1,5-naphthyridin-3-yl)methyl]piperazin-1-yl]-N-[(3R)-oxan-3-yl]pyridine-2-carboxamide
CID 167844996
5-[4-[1-[(3S)-3-ethyl-2-oxo-1H-pyrido[2,3-b][1,4]oxazin-7-yl]ethyl]piperazin-1-yl]-N-methylpyridine-2-carboxamide
CID 169189563
N-methyl-5-[4-(3-methylpyrrol-1-yl)piperidin-1-yl]pyridine-2-carboxamide
CID 169148857
5-(4-acetylpiperazin-1-yl)-N-(2,6-dimethylphenyl)pyridine-2-carboxamide
CID 109187407
5-[4-(4-fluorophenyl)piperazin-1-yl]-N-propan-2-ylpyridine-2-carboxamide
CID 109179488
5-[3-(hydroxymethyl)piperazin-1-yl]-N-methylpyridine-2-carboxamide
CID 167179178
N-methyl-5-[4-[4-[(Z)-N-methylidene-N'-[2-methyl-1-(methylamino)prop-1-enyl]carbamimidoyl]hexan-2-yl]piperazin-1-yl]pyridine-2-carboxamide
CID 176964920
(10S)-N-methyl-12-[(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)methyl]-8-oxa-1,6,12-triazatricyclo[8.4.0.02,7]tetradeca-2(7),3,5-triene-5-carboxamide
CID 167845013
5-[4-[3-fluoropentyl(methyl)amino]piperidin-1-yl]-N-methylpyridine-2-carboxamide
CID 169149204
ethane;5-[4-[3-(5-ethyl-6-methoxy-2-pyridinyl)cyclopent-2-en-1-yl]piperazin-1-yl]-N-methylpyridine-2-carboxamide
CID 176560444

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide?
The IUPAC name of N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide (CID 167845050) is N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide?
The canonical SMILES for N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide is CNC(=O)c1ccc(N2CCN([C@@H](C)C3=CC4=NC(=O)C(C)=CC4N=C3)CC2)cn1.
What is the InChIKey of N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide?
The InChIKey is ARYKAXXCFIDCEN-FUKCDUGKSA-N. The full InChI is InChI=1S/C22H26N6O2/c1-14-10-19-20(26-21(14)29)11-16(12-24-19)15(2)27-6-8-28(9-7-27)17-4-5-18(25-13-17)22(30)23-3/h4-5,10-13,15,19H,6-9H2,1-3H3,(H,23,30)/t15-,19?/m0/s1.
What are the key properties of N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide?
N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide has a molecular weight of 406.49 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[4-[(1S)-1-(7-methyl-6-oxo-8aH-1,5-naphthyridin-3-yl)ethyl]piperazin-1-yl]pyridine-2-carboxamide is sourced from PubChem (CID 167845050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).