2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride

C10H19ClF2N2O — CID 119320693

IUPAC2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)N(CC(F)F)C1CC1.Cl
InChIInChI=1S/C10H18F2N2O.ClH/c1-2-3-8(13)10(15)14(6-9(11)12)7-4-5-7;/h7-9H,2-6,13H2,1H3;1H
InChIKeyQTVCUXMKADPFET-UHFFFAOYSA-N
MW256.72 g/mol
LogP1.79
Rot. Bonds6

About 2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride

2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride (PubChem CID 119320693) has the molecular formula C10H19ClF2N2O and a molecular weight of 256.72 g/mol. Its IUPAC name is 2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride
PubChem CID119320693
Molecular FormulaC10H19ClF2N2O
Molecular Weight256.72 g/mol
Exact Mass256.12
IUPAC Name2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)N(CC(F)F)C1CC1.Cl
InChIInChI=1S/C10H18F2N2O.ClH/c1-2-3-8(13)10(15)14(6-9(11)12)7-4-5-7;/h7-9H,2-6,13H2,1H3;1H
InChIKeyQTVCUXMKADPFET-UHFFFAOYSA-N
XLogP1.79
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.72
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-cyclopropyl-N-(2-methoxyethyl)pentanamide
CID 60947244
(2R)-2-amino-N-cyclopentyl-N-(3-methylbutyl)pentanamide
CID 103795443
(2S)-2-amino-N-cyclopropyl-N-propylhexanamide
CID 103950188
2-amino-N-cyclopropyl-N-[(4-ethylphenyl)methyl]pentanamide
CID 60938574
(2R)-2-amino-N-cyclobutyl-N-methylpentanamide
CID 103797073
(2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)pentanamide
CID 107571038
(2S)-2-amino-N,N-dicyclohexylpentanamide
CID 107568011
(2S)-2-amino-N-cyclopropyl-N-(2-hydroxyethyl)hexanamide
CID 103951026
2-amino-N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pentanamide;hydrochloride
CID 119298871
2-amino-N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]pentanamide;hydrochloride
CID 119345192
(2S)-2-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)pentanamide
CID 93369625
(2S)-2-amino-N-[(2-bromophenyl)methyl]-N-cyclopropylpentanamide
CID 93370556

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride (CID 119320693) is 2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride is CCCC(N)C(=O)N(CC(F)F)C1CC1.Cl.
What is the InChIKey of 2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride?
The InChIKey is QTVCUXMKADPFET-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F2N2O.ClH/c1-2-3-8(13)10(15)14(6-9(11)12)7-4-5-7;/h7-9H,2-6,13H2,1H3;1H.
What are the key properties of 2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride?
2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride has a molecular weight of 256.72 g/mol, XLogP of 1.79, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclopropyl-N-(2,2-difluoroethyl)pentanamide;hydrochloride is sourced from PubChem (CID 119320693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).