2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide

C16H26N2O — CID 106151106

IUPAC2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)NC(C)CCC(C)C)cc1
InChIInChI=1S/C16H26N2O/c1-11(2)5-8-13(4)18-16(19)15(17)14-9-6-12(3)7-10-14/h6-7,9-11,13,15H,5,8,17H2,1-4H3,(H,18,19)
InChIKeyYJBMCEVSNRAMIK-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.94
Rot. Bonds6

About 2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide

2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide (PubChem CID 106151106) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide
PubChem CID106151106
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)NC(C)CCC(C)C)cc1
InChIInChI=1S/C16H26N2O/c1-11(2)5-8-13(4)18-16(19)15(17)14-9-6-12(3)7-10-14/h6-7,9-11,13,15H,5,8,17H2,1-4H3,(H,18,19)
InChIKeyYJBMCEVSNRAMIK-UHFFFAOYSA-N
XLogP2.94
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(5-methylhexan-2-yl)-2-phenylacetamide
CID 43579340
2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide
CID 106151030
2-amino-N-(1-ethylsulfanylpropan-2-yl)-2-(4-methylphenyl)acetamide
CID 114150574
2-amino-N-(1,1-dimethoxypropan-2-yl)-2-(4-methylphenyl)acetamide
CID 106312416
methyl (2S)-2-[[2-amino-2-(4-methylphenyl)acetyl]amino]-4-methylpentanoate
CID 106312676
2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668952
2-[[2-amino-2-(4-methylphenyl)acetyl]amino]-N-ethylpropanamide
CID 106151190
2-amino-N-(3-methylpentan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120667739
3-[[2-amino-2-(4-methylphenyl)acetyl]amino]-2-methylbutanoic acid
CID 106312699
(2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide
CID 81357033
2-amino-2-(4-methylphenyl)-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]acetamide
CID 120667536
methyl 2-[[2-amino-2-(4-methylphenyl)acetyl]amino]-3-methylbutanoate
CID 106312267

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide?
The IUPAC name of 2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide (CID 106151106) is 2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide?
The canonical SMILES for 2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide is Cc1ccc(C(N)C(=O)NC(C)CCC(C)C)cc1.
What is the InChIKey of 2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide?
The InChIKey is YJBMCEVSNRAMIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-11(2)5-8-13(4)18-16(19)15(17)14-9-6-12(3)7-10-14/h6-7,9-11,13,15H,5,8,17H2,1-4H3,(H,18,19).
What are the key properties of 2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide?
2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide has a molecular weight of 262.40 g/mol, XLogP of 2.94, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 106151106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).