N-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide

C15H22F2N2O — CID 106286035

IUPACN-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide
SMILESCCC(CC)C(N)CNC(=O)Cc1ccc(F)cc1F
InChIInChI=1S/C15H22F2N2O/c1-3-10(4-2)14(18)9-19-15(20)7-11-5-6-12(16)8-13(11)17/h5-6,8,10,14H,3-4,7,9,18H2,1-2H3,(H,19,20)
InChIKeyGRXAFWPGJPKYMD-UHFFFAOYSA-N
MW284.35 g/mol
LogP2.39
Rot. Bonds7

About N-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide

N-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide (PubChem CID 106286035) has the molecular formula C15H22F2N2O and a molecular weight of 284.35 g/mol. Its IUPAC name is N-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide.

Molecular Properties

Compound NameN-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide
PubChem CID106286035
Molecular FormulaC15H22F2N2O
Molecular Weight284.35 g/mol
Exact Mass284.17
IUPAC NameN-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide
SMILESCCC(CC)C(N)CNC(=O)Cc1ccc(F)cc1F
InChIInChI=1S/C15H22F2N2O/c1-3-10(4-2)14(18)9-19-15(20)7-11-5-6-12(16)8-13(11)17/h5-6,8,10,14H,3-4,7,9,18H2,1-2H3,(H,19,20)
InChIKeyGRXAFWPGJPKYMD-UHFFFAOYSA-N
XLogP2.39
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.35
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide
CID 106288520
N-(2-amino-3-ethylpentyl)-5-fluoro-2-hydroxybenzamide
CID 106286447
N-(2-amino-2-methylpropyl)-2-(2,4-difluorophenyl)acetamide;hydrochloride
CID 119629495
2-amino-N-[(2,4-difluorophenyl)methyl]-3-methylpentanamide
CID 55053137
N-(5-amino-2,2-dimethylpentyl)-2-(2,4-difluorophenyl)acetamide
CID 106140618
4-amino-1-(2,4-difluorophenyl)-5-methylhexan-2-one
CID 116606369
3-amino-N-[(2,4-difluorophenyl)methyl]butanamide;hydrochloride
CID 119708041
(2R)-2-amino-N-[(2,4-difluorophenyl)methyl]propanamide;hydrochloride
CID 119280925
(2S)-2-amino-N-[(2,4-difluorophenyl)methyl]-3,3-dimethylbutanamide;hydrochloride
CID 119708034
3-chloro-N-[(2,4-difluorophenyl)methyl]-2-methylpropanamide
CID 62726867
2-(2,4-difluorophenyl)-N-pent-3-ynylacetamide
CID 104581240
4-amino-1-(2,4-difluorophenyl)-6,6-dimethylheptan-2-one
CID 116614717

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide?
The IUPAC name of N-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide (CID 106286035) is N-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide.
What is the SMILES notation for N-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide?
The canonical SMILES for N-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide is CCC(CC)C(N)CNC(=O)Cc1ccc(F)cc1F.
What is the InChIKey of N-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide?
The InChIKey is GRXAFWPGJPKYMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22F2N2O/c1-3-10(4-2)14(18)9-19-15(20)7-11-5-6-12(16)8-13(11)17/h5-6,8,10,14H,3-4,7,9,18H2,1-2H3,(H,19,20).
What are the key properties of N-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide?
N-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide has a molecular weight of 284.35 g/mol, XLogP of 2.39, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-3-ethylpentyl)-2-(2,4-difluorophenyl)acetamide is sourced from PubChem (CID 106286035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).