4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide

C16H26N2O — CID 112516984

IUPAC4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide
SMILESCC(C)NC(=O)C(CCN)c1ccc(C(C)C)cc1
InChIInChI=1S/C16H26N2O/c1-11(2)13-5-7-14(8-6-13)15(9-10-17)16(19)18-12(3)4/h5-8,11-12,15H,9-10,17H2,1-4H3,(H,18,19)
InChIKeyYUMGYLDOQDANQB-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.77
Rot. Bonds6

About 4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide

4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide (PubChem CID 112516984) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide.

Molecular Properties

Compound Name4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide
PubChem CID112516984
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide
SMILESCC(C)NC(=O)C(CCN)c1ccc(C(C)C)cc1
InChIInChI=1S/C16H26N2O/c1-11(2)13-5-7-14(8-6-13)15(9-10-17)16(19)18-12(3)4/h5-8,11-12,15H,9-10,17H2,1-4H3,(H,18,19)
InChIKeyYUMGYLDOQDANQB-UHFFFAOYSA-N
XLogP2.77
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 ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-2-[4-(dimethylamino)phenyl]-N-propan-2-ylbutanamide
CID 112517188
5-amino-N-methyl-2-(4-propan-2-ylphenyl)pentanamide
CID 112516027
4-amino-2-(4-fluorophenyl)-N-(2-methylpropyl)butanamide
CID 112516304
4-amino-N-(2-methylpropyl)-2-phenylbutanamide
CID 112515492
N-propan-2-yl-2-(4-propan-2-ylanilino)propanamide
CID 43084814
N-(1-amino-4-methylpentan-3-yl)-2-phenylbutanamide
CID 106356833
N-propan-2-yl-2-[1-(4-propan-2-ylphenyl)ethylamino]acetamide
CID 43398085
N-(4-amino-2-methylbutyl)-4-propan-2-ylbenzamide
CID 66090894
ethyl 2-(4-propan-2-ylphenyl)pentanoate
CID 83042532
2-(4-chlorophenyl)-4-oxo-4-(propan-2-ylamino)butanoic acid
CID 82134375
methyl 4-amino-2-phenylbutanoate;hydrochloride
CID 66905089
4-amino-N-[1-(3,4-dichlorophenyl)ethyl]-2-methylbutanamide
CID 80543571

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide?
The IUPAC name of 4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide (CID 112516984) is 4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide.
What is the SMILES notation for 4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide?
The canonical SMILES for 4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide is CC(C)NC(=O)C(CCN)c1ccc(C(C)C)cc1.
What is the InChIKey of 4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide?
The InChIKey is YUMGYLDOQDANQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-11(2)13-5-7-14(8-6-13)15(9-10-17)16(19)18-12(3)4/h5-8,11-12,15H,9-10,17H2,1-4H3,(H,18,19).
What are the key properties of 4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide?
4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide has a molecular weight of 262.40 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-propan-2-yl-2-(4-propan-2-ylphenyl)butanamide is sourced from PubChem (CID 112516984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).