N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide

C21H38N4O3 — CID 120646192

IUPACN-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide
SMILESCOCC1(C(=O)N2CCN(CC(=O)N(C)C3CCCCC3)CC2)CCNCC1
InChIInChI=1S/C21H38N4O3/c1-23(18-6-4-3-5-7-18)19(26)16-24-12-14-25(15-13-24)20(27)21(17-28-2)8-10-22-11-9-21/h18,22H,3-17H2,1-2H3
InChIKeyZAASGSUYMWBKAE-UHFFFAOYSA-N
MW394.56 g/mol
LogP0.94
Rot. Bonds6

About N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide

N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide (PubChem CID 120646192) has the molecular formula C21H38N4O3 and a molecular weight of 394.56 g/mol. Its IUPAC name is N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide
PubChem CID120646192
Molecular FormulaC21H38N4O3
Molecular Weight394.56 g/mol
Exact Mass394.29
IUPAC NameN-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide
SMILESCOCC1(C(=O)N2CCN(CC(=O)N(C)C3CCCCC3)CC2)CCNCC1
InChIInChI=1S/C21H38N4O3/c1-23(18-6-4-3-5-7-18)19(26)16-24-12-14-25(15-13-24)20(27)21(17-28-2)8-10-22-11-9-21/h18,22H,3-17H2,1-2H3
InChIKeyZAASGSUYMWBKAE-UHFFFAOYSA-N
XLogP0.94
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.56
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide 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-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 120640227
N-cyclopentyl-N-methyl-2-piperazin-1-ylacetamide
CID 43267406
[4-(2-methoxyethyl)piperazin-1-yl]-[4-(methoxymethyl)piperidin-4-yl]methanone
CID 120640752
[4-(methoxymethyl)piperidin-4-yl]-(4-propan-2-ylazepan-1-yl)methanone;hydrochloride
CID 120633382
1-(4-ethylpiperazin-1-yl)-2-[1-[4-(methoxymethyl)piperidine-4-carbonyl]piperidin-4-yl]ethanone
CID 120646385
2-[4-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]piperazin-1-yl]acetic acid
CID 43521865
N-cyclohexyl-N-methyl-2-[4-[(2R)-piperidine-2-carbonyl]piperazin-1-yl]acetamide
CID 119876689
1-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-2,2-dimethylpropan-1-one
CID 120620516
N-cyclopropyl-4-(methoxymethyl)-N-methylpiperidine-4-carboxamide;hydrochloride
CID 120622234
1-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-2-methylpropan-1-one;hydrochloride
CID 120617943
[4-(diethylaminomethyl)piperidin-1-yl]-[4-(methoxymethyl)piperidin-4-yl]methanone;dihydrochloride
CID 120642749
[4-(methoxymethyl)piperidin-4-yl]-(3-phenylpyrrolidin-1-yl)methanone
CID 120622590

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide?
The IUPAC name of N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide (CID 120646192) is N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide.
What is the SMILES notation for N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide?
The canonical SMILES for N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide is COCC1(C(=O)N2CCN(CC(=O)N(C)C3CCCCC3)CC2)CCNCC1.
What is the InChIKey of N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide?
The InChIKey is ZAASGSUYMWBKAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H38N4O3/c1-23(18-6-4-3-5-7-18)19(26)16-24-12-14-25(15-13-24)20(27)21(17-28-2)8-10-22-11-9-21/h18,22H,3-17H2,1-2H3.
What are the key properties of N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide?
N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide has a molecular weight of 394.56 g/mol, XLogP of 0.94, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[4-[4-(methoxymethyl)piperidine-4-carbonyl]piperazin-1-yl]-N-methylacetamide is sourced from PubChem (CID 120646192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).