N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide

C19H30N4O2 — CID 3228714

IUPACN-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide
SMILESCCOc1cc(C)nc(N2CCC(C(=O)NC3CCCCC3)CC2)n1
InChIInChI=1S/C19H30N4O2/c1-3-25-17-13-14(2)20-19(22-17)23-11-9-15(10-12-23)18(24)21-16-7-5-4-6-8-16/h13,15-16H,3-12H2,1-2H3,(H,21,24)
InChIKeyYRXBHPYHINDCIW-UHFFFAOYSA-N
MW346.48 g/mol
LogP2.85
Rot. Bonds5

About N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide

N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide (PubChem CID 3228714) has the molecular formula C19H30N4O2 and a molecular weight of 346.48 g/mol. Its IUPAC name is N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide
PubChem CID3228714
Molecular FormulaC19H30N4O2
Molecular Weight346.48 g/mol
Exact Mass346.24
IUPAC NameN-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide
SMILESCCOc1cc(C)nc(N2CCC(C(=O)NC3CCCCC3)CC2)n1
InChIInChI=1S/C19H30N4O2/c1-3-25-17-13-14(2)20-19(22-17)23-11-9-15(10-12-23)18(24)21-16-7-5-4-6-8-16/h13,15-16H,3-12H2,1-2H3,(H,21,24)
InChIKeyYRXBHPYHINDCIW-UHFFFAOYSA-N
XLogP2.85
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.48
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-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

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide?
The IUPAC name of N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide (CID 3228714) is N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide?
The canonical SMILES for N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide is CCOc1cc(C)nc(N2CCC(C(=O)NC3CCCCC3)CC2)n1.
What is the InChIKey of N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide?
The InChIKey is YRXBHPYHINDCIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O2/c1-3-25-17-13-14(2)20-19(22-17)23-11-9-15(10-12-23)18(24)21-16-7-5-4-6-8-16/h13,15-16H,3-12H2,1-2H3,(H,21,24).
What are the key properties of N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide?
N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide has a molecular weight of 346.48 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 3228714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).