N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide

C19H27N3O4 — CID 110810749

IUPACN-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide
SMILESCOc1cccc(OC)c1C(=O)N1CCN(C(=O)NC2CCCC2)CC1
InChIInChI=1S/C19H27N3O4/c1-25-15-8-5-9-16(26-2)17(15)18(23)21-10-12-22(13-11-21)19(24)20-14-6-3-4-7-14/h5,8-9,14H,3-4,6-7,10-13H2,1-2H3,(H,20,24)
InChIKeyPGIYEVUKFOHVGC-UHFFFAOYSA-N
MW361.44 g/mol
LogP2.11
Rot. Bonds4

About N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide

N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide (PubChem CID 110810749) has the molecular formula C19H27N3O4 and a molecular weight of 361.44 g/mol. Its IUPAC name is N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide
PubChem CID110810749
Molecular FormulaC19H27N3O4
Molecular Weight361.44 g/mol
Exact Mass361.20
IUPAC NameN-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide
SMILESCOc1cccc(OC)c1C(=O)N1CCN(C(=O)NC2CCCC2)CC1
InChIInChI=1S/C19H27N3O4/c1-25-15-8-5-9-16(26-2)17(15)18(23)21-10-12-22(13-11-21)19(24)20-14-6-3-4-7-14/h5,8-9,14H,3-4,6-7,10-13H2,1-2H3,(H,20,24)
InChIKeyPGIYEVUKFOHVGC-UHFFFAOYSA-N
XLogP2.11
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.44
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-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-cyclopentyl-4-(2-methoxyphenyl)piperazine-1-carboxamide
CID 17452485
N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]-2,6-dimethoxybenzamide
CID 108549752
N-cyclohexyl-4-(2,6-difluorobenzoyl)piperazine-1-carboxamide
CID 47784765
N-cyclopentyl-4-(2-methoxyphenyl)sulfonylpiperazine-1-carboxamide
CID 110811227
methyl 4-(2,6-dimethoxybenzoyl)piperazine-1-carboxylate
CID 110818263
2-chloro-N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]acetamide
CID 108563833
3-cyclohexyl-N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]propanamide
CID 108555663
N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide
CID 110820607
N-cyclohexyl-4-[2-[1-(2-methoxyphenyl)ethylamino]-2-oxoethyl]piperazine-1-carboxamide
CID 112820092
N-cyclopentyl-4-(3-methylbenzoyl)-1,4-diazepane-1-carboxamide
CID 38217781
1-cyclohexyl-3-[1-(2-methoxybenzoyl)piperidin-4-yl]urea
CID 127232346
N-cycloheptyl-4-(2,5-dimethoxyphenyl)piperazine-1-carboxamide
CID 113110606

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide?
The IUPAC name of N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide (CID 110810749) is N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide?
The canonical SMILES for N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide is COc1cccc(OC)c1C(=O)N1CCN(C(=O)NC2CCCC2)CC1.
What is the InChIKey of N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide?
The InChIKey is PGIYEVUKFOHVGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O4/c1-25-15-8-5-9-16(26-2)17(15)18(23)21-10-12-22(13-11-21)19(24)20-14-6-3-4-7-14/h5,8-9,14H,3-4,6-7,10-13H2,1-2H3,(H,20,24).
What are the key properties of N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide?
N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide has a molecular weight of 361.44 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide is sourced from PubChem (CID 110810749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).