N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide

C16H26N2O — CID 115271670

IUPACN-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide
SMILESCC(C)Cc1ccc(CC(=O)NCC(C)CN)cc1
InChIInChI=1S/C16H26N2O/c1-12(2)8-14-4-6-15(7-5-14)9-16(19)18-11-13(3)10-17/h4-7,12-13H,8-11,17H2,1-3H3,(H,18,19)
InChIKeySXJSVSJPCOGKPF-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.14
Rot. Bonds7

About N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide

N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide (PubChem CID 115271670) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide
PubChem CID115271670
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide
SMILESCC(C)Cc1ccc(CC(=O)NCC(C)CN)cc1
InChIInChI=1S/C16H26N2O/c1-12(2)8-14-4-6-15(7-5-14)9-16(19)18-11-13(3)10-17/h4-7,12-13H,8-11,17H2,1-3H3,(H,18,19)
InChIKeySXJSVSJPCOGKPF-UHFFFAOYSA-N
XLogP2.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-amino-2-methylpropyl)-2-(4-propan-2-yloxyphenyl)acetamide
CID 115271689
N-(3-amino-2-methylpropyl)-3-[(2-phenylacetyl)amino]propanamide
CID 119996452
2-[4-(2-methylpropyl)phenyl]-N-propylacetamide
CID 78814444
N-(2-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride
CID 119628469
N-(3-hydroxybutyl)-2-[4-(2-methylpropyl)phenyl]acetamide
CID 111428861
2-(4-aminophenyl)-N-(2-methylpropyl)acetamide
CID 16776382
N-(2-methoxyethyl)-2-[4-(2-methylpropyl)phenyl]acetamide
CID 78814646
2-[4-(2-methylpropyl)phenyl]-N-propan-2-ylacetamide
CID 78814712
N-(3-amino-2-methylpropyl)-2-(2-fluorophenyl)acetamide
CID 62666475
5-[[2-(4-aminophenyl)acetyl]amino]-4-methylpentanoic acid
CID 82687958
N-(3-amino-2-methylpropyl)-3-(4-methylphenyl)propanamide;hydrochloride
CID 119995634
2-amino-N-(3-amino-2-methylpropyl)acetamide
CID 130703152

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide?
The IUPAC name of N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide (CID 115271670) is N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide?
The canonical SMILES for N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide is CC(C)Cc1ccc(CC(=O)NCC(C)CN)cc1.
What is the InChIKey of N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide?
The InChIKey is SXJSVSJPCOGKPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-12(2)8-14-4-6-15(7-5-14)9-16(19)18-11-13(3)10-17/h4-7,12-13H,8-11,17H2,1-3H3,(H,18,19).
What are the key properties of N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide?
N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide has a molecular weight of 262.40 g/mol, XLogP of 2.14, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide is sourced from PubChem (CID 115271670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).