1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride

C14H19Cl3N2O — CID 119296433

IUPAC1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCl.NC1(C(=O)NCCc2cccc(Cl)c2Cl)CCCC1
InChIInChI=1S/C14H18Cl2N2O.ClH/c15-11-5-3-4-10(12(11)16)6-9-18-13(19)14(17)7-1-2-8-14;/h3-5H,1-2,6-9,17H2,(H,18,19);1H
InChIKeyFVBKTAJBPJBXNQ-UHFFFAOYSA-N
MW337.68 g/mol
LogP3.35
Rot. Bonds4

About 1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride

1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119296433) has the molecular formula C14H19Cl3N2O and a molecular weight of 337.68 g/mol. Its IUPAC name is 1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
PubChem CID119296433
Molecular FormulaC14H19Cl3N2O
Molecular Weight337.68 g/mol
Exact Mass336.06
IUPAC Name1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCl.NC1(C(=O)NCCc2cccc(Cl)c2Cl)CCCC1
InChIInChI=1S/C14H18Cl2N2O.ClH/c15-11-5-3-4-10(12(11)16)6-9-18-13(19)14(17)7-1-2-8-14;/h3-5H,1-2,6-9,17H2,(H,18,19);1H
InChIKeyFVBKTAJBPJBXNQ-UHFFFAOYSA-N
XLogP3.35
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.68
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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3-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride (CID 119296433) is 1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride is Cl.NC1(C(=O)NCCc2cccc(Cl)c2Cl)CCCC1.
What is the InChIKey of 1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is FVBKTAJBPJBXNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2N2O.ClH/c15-11-5-3-4-10(12(11)16)6-9-18-13(19)14(17)7-1-2-8-14;/h3-5H,1-2,6-9,17H2,(H,18,19);1H.
What are the key properties of 1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride?
1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 337.68 g/mol, XLogP of 3.35, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[2-(2,3-dichlorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119296433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).