N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide

C15H24N2O — CID 114152459

IUPACN-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide
SMILESCCC(C)(CCN)NC(=O)Cc1ccc(C)cc1
InChIInChI=1S/C15H24N2O/c1-4-15(3,9-10-16)17-14(18)11-13-7-5-12(2)6-8-13/h5-8H,4,9-11,16H2,1-3H3,(H,17,18)
InChIKeyHAWXXBBFGSVSQV-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.17
Rot. Bonds6

About N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide

N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide (PubChem CID 114152459) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide
PubChem CID114152459
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide
SMILESCCC(C)(CCN)NC(=O)Cc1ccc(C)cc1
InChIInChI=1S/C15H24N2O/c1-4-15(3,9-10-16)17-14(18)11-13-7-5-12(2)6-8-13/h5-8H,4,9-11,16H2,1-3H3,(H,17,18)
InChIKeyHAWXXBBFGSVSQV-UHFFFAOYSA-N
XLogP2.17
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-amino-3-methylpentan-3-yl)-2-(4-fluorophenyl)acetamide
CID 114152519
N-(1-chloro-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide
CID 114153136
N-(1-bromo-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide
CID 114153294
2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide
CID 103946030
N-(1-hydroxy-2-methylbutan-2-yl)-3-(4-methylphenyl)propanamide
CID 64558137
N-(1-amino-3-methylpentan-3-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 106164834
N-(2-amino-2-ethylbutyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 119261247
N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide
CID 106164752
3-amino-3-ethyl-1-(4-methylphenyl)pentan-2-one
CID 116592721
N-(1-chloro-3-methylpentan-3-yl)-2-naphthalen-2-ylacetamide
CID 106168408
N-(4-aminobutyl)-2-(4-methylphenyl)acetamide
CID 60895939
N-(1-amino-3-methylpentan-3-yl)nonanamide
CID 106164392

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide?
The IUPAC name of N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide (CID 114152459) is N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide is CCC(C)(CCN)NC(=O)Cc1ccc(C)cc1.
What is the InChIKey of N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide?
The InChIKey is HAWXXBBFGSVSQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-15(3,9-10-16)17-14(18)11-13-7-5-12(2)6-8-13/h5-8H,4,9-11,16H2,1-3H3,(H,17,18).
What are the key properties of N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide?
N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide has a molecular weight of 248.37 g/mol, XLogP of 2.17, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 114152459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).