3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride

C17H24Cl2N2O — CID 119715144

IUPAC3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride
SMILESCC(c1ccccc1Cl)N(C(=O)C1CCC(N)C1)C1CC1.Cl
InChIInChI=1S/C17H23ClN2O.ClH/c1-11(15-4-2-3-5-16(15)18)20(14-8-9-14)17(21)12-6-7-13(19)10-12;/h2-5,11-14H,6-10,19H2,1H3;1H
InChIKeyPRZHAYBZWXPMBN-UHFFFAOYSA-N
MW343.30 g/mol
LogP3.94
Rot. Bonds4

About 3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride

3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride (PubChem CID 119715144) has the molecular formula C17H24Cl2N2O and a molecular weight of 343.30 g/mol. Its IUPAC name is 3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride
PubChem CID119715144
Molecular FormulaC17H24Cl2N2O
Molecular Weight343.30 g/mol
Exact Mass342.13
IUPAC Name3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride
SMILESCC(c1ccccc1Cl)N(C(=O)C1CCC(N)C1)C1CC1.Cl
InChIInChI=1S/C17H23ClN2O.ClH/c1-11(15-4-2-3-5-16(15)18)20(14-8-9-14)17(21)12-6-7-13(19)10-12;/h2-5,11-14H,6-10,19H2,1H3;1H
InChIKeyPRZHAYBZWXPMBN-UHFFFAOYSA-N
XLogP3.94
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.30
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)cyclopentane-1-carboxamide
CID 119749330
(2S,5R)-5-(aminomethyl)-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropyloxolane-2-carboxamide
CID 120786660
3-amino-N-cyclopropyl-N-(1-cyclopropylethyl)cyclopentane-1-carboxamide
CID 119728873
3-amino-N-cyclobutyl-N-propan-2-ylcyclopentane-1-carboxamide
CID 119799910
ethyl 3-[1-(2-chlorophenyl)ethyl-cyclopropylcarbamoyl]piperidine-1-carboxylate
CID 78852776
3-amino-N-cyclopropyl-N-[(4-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 84584678
3-amino-N-benzyl-N-propan-2-ylcyclopentane-1-carboxamide;hydrochloride
CID 119676287
N-[1-(2-chlorophenyl)ethyl]-N-cyclopropyl-4-ethoxybutanamide
CID 78884246
3-amino-N-[2-(2-chlorophenyl)-2-hydroxyethyl]cyclopentane-1-carboxamide
CID 154759854
N-[1-(2-chlorophenyl)ethyl]-N-cyclopropyl-2-pyrrolidin-2-ylacetamide
CID 119715165
2-chloro-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropyl-5-methylsulfonylbenzamide
CID 78852755
3-amino-N-methyl-N-(2-methyl-1-phenylpropyl)cyclopentane-1-carboxamide
CID 119783511

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride (CID 119715144) is 3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride is CC(c1ccccc1Cl)N(C(=O)C1CCC(N)C1)C1CC1.Cl.
What is the InChIKey of 3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride?
The InChIKey is PRZHAYBZWXPMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23ClN2O.ClH/c1-11(15-4-2-3-5-16(15)18)20(14-8-9-14)17(21)12-6-7-13(19)10-12;/h2-5,11-14H,6-10,19H2,1H3;1H.
What are the key properties of 3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride?
3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride has a molecular weight of 343.30 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119715144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).