N-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide

C14H20F2N2O — CID 106152815

IUPACN-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide
SMILESCC(CN)CCCNC(=O)Cc1c(F)cccc1F
InChIInChI=1S/C14H20F2N2O/c1-10(9-17)4-3-7-18-14(19)8-11-12(15)5-2-6-13(11)16/h2,5-6,10H,3-4,7-9,17H2,1H3,(H,18,19)
InChIKeyAZFDLIXGCMMORW-UHFFFAOYSA-N
MW270.32 g/mol
LogP2.00
Rot. Bonds7

About N-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide

N-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide (PubChem CID 106152815) has the molecular formula C14H20F2N2O and a molecular weight of 270.32 g/mol. Its IUPAC name is N-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide.

Molecular Properties

Compound NameN-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide
PubChem CID106152815
Molecular FormulaC14H20F2N2O
Molecular Weight270.32 g/mol
Exact Mass270.15
IUPAC NameN-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide
SMILESCC(CN)CCCNC(=O)Cc1c(F)cccc1F
InChIInChI=1S/C14H20F2N2O/c1-10(9-17)4-3-7-18-14(19)8-11-12(15)5-2-6-13(11)16/h2,5-6,10H,3-4,7-9,17H2,1H3,(H,18,19)
InChIKeyAZFDLIXGCMMORW-UHFFFAOYSA-N
XLogP2.00
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.32
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-chloro-6-fluorophenyl)-N-(5-chloro-4-methylpentyl)acetamide
CID 106156758
N-(5-amino-4-methylpentyl)-2-naphthalen-1-ylacetamide
CID 106152740
N-(5-amino-4-methylpentyl)-2-(4-methylphenyl)acetamide
CID 114150778
5-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]-2-methylpentanoic acid
CID 104682499
N-(5-amino-4-methylpentyl)-4-fluoronaphthalene-1-carboxamide
CID 106153058
2-(2,3-difluorophenyl)-N-(5-hydroxy-4-methylpentyl)acetamide
CID 103862391
N-(5-amino-4-methylpentyl)-2,4-difluorobenzamide
CID 106152842
2-(2-fluorophenyl)-N-(5-hydroxy-4-methylpentyl)acetamide
CID 113340863
N-(5-amino-4-methylpentyl)-2,3,4,5,6-pentafluorobenzamide
CID 106153328
N-(5-amino-4-methylpentyl)-2-(2-methoxyphenyl)acetamide
CID 106152966
N-(3-aminobutyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 63253339
N-(5-amino-4-methylpentyl)-2-(trifluoromethyl)benzamide
CID 106152852

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide?
The IUPAC name of N-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide (CID 106152815) is N-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide.
What is the SMILES notation for N-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide?
The canonical SMILES for N-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide is CC(CN)CCCNC(=O)Cc1c(F)cccc1F.
What is the InChIKey of N-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide?
The InChIKey is AZFDLIXGCMMORW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F2N2O/c1-10(9-17)4-3-7-18-14(19)8-11-12(15)5-2-6-13(11)16/h2,5-6,10H,3-4,7-9,17H2,1H3,(H,18,19).
What are the key properties of N-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide?
N-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide has a molecular weight of 270.32 g/mol, XLogP of 2.00, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-4-methylpentyl)-2-(2,6-difluorophenyl)acetamide is sourced from PubChem (CID 106152815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).