1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride

C16H31ClN4O2 — CID 119555858

IUPAC1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride
SMILESCCNC(=O)NC1(C(=O)NCCC2CCCNC2)CCCC1.Cl
InChIInChI=1S/C16H30N4O2.ClH/c1-2-18-15(22)20-16(8-3-4-9-16)14(21)19-11-7-13-6-5-10-17-12-13;/h13,17H,2-12H2,1H3,(H,19,21)(H2,18,20,22);1H
InChIKeyCVGYGBQVJXFQQG-UHFFFAOYSA-N
MW346.90 g/mol
LogP1.55
Rot. Bonds6

About 1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride

1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119555858) has the molecular formula C16H31ClN4O2 and a molecular weight of 346.90 g/mol. Its IUPAC name is 1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride
PubChem CID119555858
Molecular FormulaC16H31ClN4O2
Molecular Weight346.90 g/mol
Exact Mass346.21
IUPAC Name1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride
SMILESCCNC(=O)NC1(C(=O)NCCC2CCCNC2)CCCC1.Cl
InChIInChI=1S/C16H30N4O2.ClH/c1-2-18-15(22)20-16(8-3-4-9-16)14(21)19-11-7-13-6-5-10-17-12-13;/h13,17H,2-12H2,1H3,(H,19,21)(H2,18,20,22);1H
InChIKeyCVGYGBQVJXFQQG-UHFFFAOYSA-N
XLogP1.55
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.90
LogP ≤ 51.55
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethyl-N-(2-piperidin-3-ylethyl)cyclopropane-1-carboxamide;hydrochloride
CID 119559587
1-methyl-N-(2-piperidin-3-ylethyl)cyclopropane-1-carboxamide;hydrochloride
CID 119555728
1-(ethylcarbamoylamino)-N-[2-(methylamino)ethyl]cyclopentane-1-carboxamide
CID 119500778
1-(4-chlorophenyl)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride
CID 119556453
N-ethyl-2-[(3S)-piperidin-3-yl]ethanamine
CID 94540790
2,3-dimethyl-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride
CID 119555477
3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
CID 119555798
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride
CID 119557894
2-(cyclopentylmethyl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride
CID 119555362
1-(4-methylphenyl)sulfanyl-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide
CID 119556086
2-cyclohexyl-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119260693
2-cycloheptyl-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119557821

Frequently Asked Questions

What is the IUPAC name of 1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride (CID 119555858) is 1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride is CCNC(=O)NC1(C(=O)NCCC2CCCNC2)CCCC1.Cl.
What is the InChIKey of 1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is CVGYGBQVJXFQQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O2.ClH/c1-2-18-15(22)20-16(8-3-4-9-16)14(21)19-11-7-13-6-5-10-17-12-13;/h13,17H,2-12H2,1H3,(H,19,21)(H2,18,20,22);1H.
What are the key properties of 1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride?
1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 346.90 g/mol, XLogP of 1.55, 6 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119555858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).