2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride

C9H17ClF2N2O — CID 119752873

IUPAC2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride
SMILESCN(CC(F)F)C(=O)C1CCCC1N.Cl
InChIInChI=1S/C9H16F2N2O.ClH/c1-13(5-8(10)11)9(14)6-3-2-4-7(6)12;/h6-8H,2-5,12H2,1H3;1H
InChIKeyJVFXVIWVVLJEGM-UHFFFAOYSA-N
MW242.70 g/mol
LogP1.26
Rot. Bonds3

About 2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride

2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride (PubChem CID 119752873) has the molecular formula C9H17ClF2N2O and a molecular weight of 242.70 g/mol. Its IUPAC name is 2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride
PubChem CID119752873
Molecular FormulaC9H17ClF2N2O
Molecular Weight242.70 g/mol
Exact Mass242.10
IUPAC Name2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride
SMILESCN(CC(F)F)C(=O)C1CCCC1N.Cl
InChIInChI=1S/C9H16F2N2O.ClH/c1-13(5-8(10)11)9(14)6-3-2-4-7(6)12;/h6-8H,2-5,12H2,1H3;1H
InChIKeyJVFXVIWVVLJEGM-UHFFFAOYSA-N
XLogP1.26
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.70
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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cis-(1R,2S)-2-amino-N-methyl-N-propylcycloheptane-1-carboxamide
CID 97051119
4-[(2-aminocyclopentanecarbonyl)-methylamino]butanoic acid
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2-amino-N-[(2-fluorophenyl)methyl]-N-methylcyclopentane-1-carboxamide;hydrochloride
CID 119682173
3-amino-N-(2,2-difluoroethyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119752879
2-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119729303
2-amino-N-methyl-N-(oxolan-2-ylmethyl)cyclopentane-1-carboxamide
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2-amino-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylcyclopentane-1-carboxamide;dihydrochloride
CID 119882077
2-amino-N-ethyl-N-propan-2-ylcyclopentane-1-carboxamide
CID 64824092
2-amino-N-[(2-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide;hydrochloride
CID 119682653

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride (CID 119752873) is 2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride is CN(CC(F)F)C(=O)C1CCCC1N.Cl.
What is the InChIKey of 2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride?
The InChIKey is JVFXVIWVVLJEGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F2N2O.ClH/c1-13(5-8(10)11)9(14)6-3-2-4-7(6)12;/h6-8H,2-5,12H2,1H3;1H.
What are the key properties of 2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride?
2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride has a molecular weight of 242.70 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,2-difluoroethyl)-N-methylcyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119752873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).