N-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide

C19H33N3O2 — CID 109145772

IUPACN-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide
SMILESCCN1CCN(C(=O)C2CCC(C(=O)NC3CCCC3)CC2)CC1
InChIInChI=1S/C19H33N3O2/c1-2-21-11-13-22(14-12-21)19(24)16-9-7-15(8-10-16)18(23)20-17-5-3-4-6-17/h15-17H,2-14H2,1H3,(H,20,23)
InChIKeyATQPRMGNMKFPCC-UHFFFAOYSA-N
MW335.49 g/mol
LogP2.02
Rot. Bonds4

About N-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide

N-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide (PubChem CID 109145772) has the molecular formula C19H33N3O2 and a molecular weight of 335.49 g/mol. Its IUPAC name is N-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide
PubChem CID109145772
Molecular FormulaC19H33N3O2
Molecular Weight335.49 g/mol
Exact Mass335.26
IUPAC NameN-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide
SMILESCCN1CCN(C(=O)C2CCC(C(=O)NC3CCCC3)CC2)CC1
InChIInChI=1S/C19H33N3O2/c1-2-21-11-13-22(14-12-21)19(24)16-9-7-15(8-10-16)18(23)20-17-5-3-4-6-17/h15-17H,2-14H2,1H3,(H,20,23)
InChIKeyATQPRMGNMKFPCC-UHFFFAOYSA-N
XLogP2.02
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.49
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-4-(4-ethylpiperazine-1-carbonyl)piperidine-1-carboxamide
CID 113003723
1-(cyclohexanecarbonyl)-N-cyclopentylpiperidine-4-carboxamide
CID 113002958
N-cycloheptyl-4-ethylpiperazine-1-carboxamide
CID 108988502
N-cyclohexyl-4-(4-formylpiperazine-1-carbonyl)cyclohexane-1-carboxamide
CID 109146089
N-[1-(4-butylcyclohexanecarbonyl)piperidin-4-yl]cyclohexanecarboxamide
CID 60597292
ethyl 4-[[1-(cyclopropanecarbonyl)piperidine-4-carbonyl]amino]piperidine-1-carboxylate
CID 51165095
2-[1-[4-(cyclopentanecarbonylamino)cyclohexanecarbonyl]piperidin-4-yl]acetic acid
CID 119178723
N-(4-chlorophenyl)-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide
CID 109147556
N-cyclohexyl-4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)cyclohexane-1-carboxamide
CID 109146126
1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide
CID 2982201
N-cycloheptyl-3-(4-ethylpiperazin-1-yl)-2,2-dimethyl-3-oxopropanamide
CID 108960902
2-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-1-cyclopentylguanidine;hydroiodide
CID 119147656

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide?
The IUPAC name of N-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide (CID 109145772) is N-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide?
The canonical SMILES for N-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide is CCN1CCN(C(=O)C2CCC(C(=O)NC3CCCC3)CC2)CC1.
What is the InChIKey of N-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide?
The InChIKey is ATQPRMGNMKFPCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33N3O2/c1-2-21-11-13-22(14-12-21)19(24)16-9-7-15(8-10-16)18(23)20-17-5-3-4-6-17/h15-17H,2-14H2,1H3,(H,20,23).
What are the key properties of N-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide?
N-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide has a molecular weight of 335.49 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(4-ethylpiperazine-1-carbonyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 109145772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).