1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride

C16H25ClN2O — CID 119305766

IUPAC1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride
SMILESCC(C)c1cccc(N(C)C(=O)C2(N)CCCC2)c1.Cl
InChIInChI=1S/C16H24N2O.ClH/c1-12(2)13-7-6-8-14(11-13)18(3)15(19)16(17)9-4-5-10-16;/h6-8,11-12H,4-5,9-10,17H2,1-3H3;1H
InChIKeyULXRIQQILMZIRB-UHFFFAOYSA-N
MW296.84 g/mol
LogP3.47
Rot. Bonds3

About 1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride

1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119305766) has the molecular formula C16H25ClN2O and a molecular weight of 296.84 g/mol. Its IUPAC name is 1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride
PubChem CID119305766
Molecular FormulaC16H25ClN2O
Molecular Weight296.84 g/mol
Exact Mass296.17
IUPAC Name1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride
SMILESCC(C)c1cccc(N(C)C(=O)C2(N)CCCC2)c1.Cl
InChIInChI=1S/C16H24N2O.ClH/c1-12(2)13-7-6-8-14(11-13)18(3)15(19)16(17)9-4-5-10-16;/h6-8,11-12H,4-5,9-10,17H2,1-3H3;1H
InChIKeyULXRIQQILMZIRB-UHFFFAOYSA-N
XLogP3.47
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.84
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-methyl-N-phenylcyclopentane-1-carboxamide;hydrochloride
CID 119261831
(2S)-2-amino-N-methyl-N-(3-propan-2-ylphenyl)propanamide;hydrochloride
CID 119305750
1-amino-N-(4-fluorophenyl)-N-methylcyclohexane-1-carboxamide;hydrochloride
CID 119292825
1-amino-N-(4-tert-butylphenyl)-N-methylcyclopentane-1-carboxamide;hydrochloride
CID 119302215
3-amino-N-methyl-N-(3-propan-2-ylphenyl)propanamide
CID 119305753
N-methyl-N-(3-propan-2-ylphenyl)prop-2-enamide
CID 163441279
N-methyl-N-(3-propan-2-ylphenyl)-2-sulfanylacetamide
CID 21131546
N-methyl-N-(3-propan-2-ylphenyl)pyrrolidine-3-carboxamide
CID 119752994
1-amino-N-(4-fluorophenyl)-N-methylcyclobutane-1-carboxamide
CID 81169719
N-methyl-1,1-dioxo-N-(3-propan-2-ylphenyl)-1,4-thiazinane-2-carboxamide
CID 155955403
1-amino-N-(4-cyanophenyl)-N-methylcyclopentane-1-carboxamide
CID 55141779
1-amino-N-methyl-N-(4-methylsulfanylphenyl)cyclohexane-1-carboxamide
CID 119320851

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride (CID 119305766) is 1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride is CC(C)c1cccc(N(C)C(=O)C2(N)CCCC2)c1.Cl.
What is the InChIKey of 1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is ULXRIQQILMZIRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O.ClH/c1-12(2)13-7-6-8-14(11-13)18(3)15(19)16(17)9-4-5-10-16;/h6-8,11-12H,4-5,9-10,17H2,1-3H3;1H.
What are the key properties of 1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride?
1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 296.84 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-methyl-N-(3-propan-2-ylphenyl)cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119305766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).