N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide

C17H30N4O2 — CID 119727444

IUPACN-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide
SMILESO=C(CC1CCCN1)N1CCN(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C17H30N4O2/c22-16(13-15-7-4-8-18-15)20-9-11-21(12-10-20)17(23)19-14-5-2-1-3-6-14/h14-15,18H,1-13H2,(H,19,23)
InChIKeyQFLDFFYFYIAAQO-UHFFFAOYSA-N
MW322.45 g/mol
LogP1.32
Rot. Bonds3

About N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide

N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide (PubChem CID 119727444) has the molecular formula C17H30N4O2 and a molecular weight of 322.45 g/mol. Its IUPAC name is N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide
PubChem CID119727444
Molecular FormulaC17H30N4O2
Molecular Weight322.45 g/mol
Exact Mass322.24
IUPAC NameN-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide
SMILESO=C(CC1CCCN1)N1CCN(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C17H30N4O2/c22-16(13-15-7-4-8-18-15)20-9-11-21(12-10-20)17(23)19-14-5-2-1-3-6-14/h14-15,18H,1-13H2,(H,19,23)
InChIKeyQFLDFFYFYIAAQO-UHFFFAOYSA-N
XLogP1.32
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)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

1-(azocan-1-yl)-2-pyrrolidin-2-ylethanone
CID 61372180
2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone
CID 29083930
2-methyl-N-[1-(2-pyrrolidin-2-ylacetyl)piperidin-4-yl]propanamide;hydrochloride
CID 119734420
N-cyclooctyl-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119674142
N-(4-methylcyclohexyl)-2-[4-(2-pyrrolidin-2-ylacetyl)piperazin-1-yl]acetamide;dihydrochloride
CID 119876672
1-(4-cyclobutylpiperazin-1-yl)-2-pyrrolidin-2-ylethanone;dihydrochloride
CID 119887210
N-cycloheptyl-2-piperidin-2-ylacetamide
CID 43346201
2-pyrrolidin-2-yl-1-thiomorpholin-4-ylethanone;hydrochloride
CID 119705182
1-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]-2-pyrrolidin-2-ylethanone;dihydrochloride
CID 119834001
2,2-dimethyl-1-[4-(2-pyrrolidin-2-ylacetyl)piperazin-1-yl]propan-1-one;hydrochloride
CID 119708849
2-piperidin-2-yl-1-(4-propan-2-ylpiperazin-1-yl)ethanone
CID 43585502
4-(2-pyrrolidin-2-ylacetyl)piperazine-1-sulfonamide;hydrochloride
CID 119701502

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide?
The IUPAC name of N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide (CID 119727444) is N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide is O=C(CC1CCCN1)N1CCN(C(=O)NC2CCCCC2)CC1.
What is the InChIKey of N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide?
The InChIKey is QFLDFFYFYIAAQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4O2/c22-16(13-15-7-4-8-18-15)20-9-11-21(12-10-20)17(23)19-14-5-2-1-3-6-14/h14-15,18H,1-13H2,(H,19,23).
What are the key properties of N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide?
N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide has a molecular weight of 322.45 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(2-pyrrolidin-2-ylacetyl)piperazine-1-carboxamide is sourced from PubChem (CID 119727444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).