5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide

C12H26N2O — CID 82688279

IUPAC5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide
SMILESCC(CN)CCC(=O)NCC(C)C(C)C
InChIInChI=1S/C12H26N2O/c1-9(2)11(4)8-14-12(15)6-5-10(3)7-13/h9-11H,5-8,13H2,1-4H3,(H,14,15)
InChIKeyPKMMXGZGFRPTIW-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.77
Rot. Bonds7

About 5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide

5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide (PubChem CID 82688279) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide.

Molecular Properties

Compound Name5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide
PubChem CID82688279
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide
SMILESCC(CN)CCC(=O)NCC(C)C(C)C
InChIInChI=1S/C12H26N2O/c1-9(2)11(4)8-14-12(15)6-5-10(3)7-13/h9-11H,5-8,13H2,1-4H3,(H,14,15)
InChIKeyPKMMXGZGFRPTIW-UHFFFAOYSA-N
XLogP1.77
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[(5-amino-4-methylpentanoyl)amino]methyl]butanoic acid
CID 82689234
7-amino-N-(2,3-dimethylbutyl)heptanamide;hydrochloride
CID 119796493
5-amino-4-methyl-N-(3-methyl-2-pyrrolidin-1-ylbutyl)pentanamide
CID 82012268
5-amino-4-methyl-N-[2-(2-methylpropanoylamino)ethyl]pentanamide
CID 82012399
5-amino-4-methyl-N-(2-methylprop-2-enyl)pentanamide
CID 114617228
(3S)-3-[[(5-amino-4-methylpentanoyl)amino]methyl]-5-methylhexanoic acid
CID 82688879
5-amino-4-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pentanamide
CID 82012433
5-amino-N-(4-hydroxybutyl)-4-methylpentanamide
CID 106842029
5-amino-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpentanamide
CID 82683387
2-[(5-amino-4-methylpentanoyl)amino]ethyl carbamate
CID 83210908
5-[(5-amino-4-methylpentanoyl)amino]pentanoic acid
CID 82689538
2-amino-N-(3-amino-2-methylpropyl)acetamide
CID 130703152

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide?
The IUPAC name of 5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide (CID 82688279) is 5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide.
What is the SMILES notation for 5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide?
The canonical SMILES for 5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide is CC(CN)CCC(=O)NCC(C)C(C)C.
What is the InChIKey of 5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide?
The InChIKey is PKMMXGZGFRPTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-9(2)11(4)8-14-12(15)6-5-10(3)7-13/h9-11H,5-8,13H2,1-4H3,(H,14,15).
What are the key properties of 5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide?
5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide has a molecular weight of 214.35 g/mol, XLogP of 1.77, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide is sourced from PubChem (CID 82688279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).