1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide

C19H24N4O2 — CID 3224208

IUPAC1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide
SMILESCOc1ccccc1NC(=O)C1CCCN(c2nc(C)cc(C)n2)C1
InChIInChI=1S/C19H24N4O2/c1-13-11-14(2)21-19(20-13)23-10-6-7-15(12-23)18(24)22-16-8-4-5-9-17(16)25-3/h4-5,8-9,11,15H,6-7,10,12H2,1-3H3,(H,22,24)
InChIKeyXMBHURITGJIRGV-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.96
Rot. Bonds4

About 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide

1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide (PubChem CID 3224208) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide
PubChem CID3224208
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide
SMILESCOc1ccccc1NC(=O)C1CCCN(c2nc(C)cc(C)n2)C1
InChIInChI=1S/C19H24N4O2/c1-13-11-14(2)21-19(20-13)23-10-6-7-15(12-23)18(24)22-16-8-4-5-9-17(16)25-3/h4-5,8-9,11,15H,6-7,10,12H2,1-3H3,(H,22,24)
InChIKeyXMBHURITGJIRGV-UHFFFAOYSA-N
XLogP2.96
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-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-methoxyphenyl)-4,6-dimethylpyrimidin-2-amine
CID 853509
1-Pyrimidin-2-yl-piperidine-3-carboxylic acid (4-methoxy-phenyl)-amide
CID 3221265
1-(4,6-dimethylpyrimidin-2-yl)-N-(4-methoxyphenyl)piperidine-3-carboxamide
CID 3224210
N-[2-[4-(2-Methoxyphenyl)-1-piperazinyl]ethyl]-4-pyrimidinecarboxamide
CID 10640987
N-(4-methoxyphenyl)-1-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperidine-4-carboxamide
CID 655328
1-{2-Amino-6-[4-(2-isopropoxy-phenyl)-piperazin-1-ylmethyl]-pyrimidin-4-ylmethyl}-piperidin-2-one
CID 12134985
6-[(2,6-dimethylpyrimidin-4-yl)amino]-4-(3-fluoro-2-methoxyanilino)-2-methyl-3a,4,5,6,7,7a-hexahydro-1H-pyrazolo[3,4-b]pyridin-3-one
CID 146047321
1-(4-Ethoxy-6-methyl-pyrimidin-2-yl)-piperidine-4-carboxylic acid (2-ethoxy-phenyl)-amide
CID 644972
N-(4-phenoxyphenyl)-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 647007
1-Pyrimidin-2-yl-piperidine-3-carboxylic acid (2,5-diethoxy-phenyl)-amide
CID 647071
1-(4,6-dimethylpyrimidin-2-yl)-N-(4-phenoxyphenyl)piperidine-4-carboxamide
CID 647340
1-(4,6-Dimethyl-pyrimidin-2-yl)-piperidine-4-carboxylic acid (2,5-dimethoxy-phenyl)-amide
CID 648223

Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide?
The IUPAC name of 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide (CID 3224208) is 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide is COc1ccccc1NC(=O)C1CCCN(c2nc(C)cc(C)n2)C1.
What is the InChIKey of 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide?
The InChIKey is XMBHURITGJIRGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-13-11-14(2)21-19(20-13)23-10-6-7-15(12-23)18(24)22-16-8-4-5-9-17(16)25-3/h4-5,8-9,11,15H,6-7,10,12H2,1-3H3,(H,22,24).
What are the key properties of 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide?
1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)piperidine-3-carboxamide is sourced from PubChem (CID 3224208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).