2-amino-N-(3,3-dimethylbutyl)pentanamide

C11H24N2O — CID 112687728

IUPAC2-amino-N-(3,3-dimethylbutyl)pentanamide
SMILESCCCC(N)C(=O)NCCC(C)(C)C
InChIInChI=1S/C11H24N2O/c1-5-6-9(12)10(14)13-8-7-11(2,3)4/h9H,5-8,12H2,1-4H3,(H,13,14)
InChIKeyBDTIXHNLOJQWMT-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.67
Rot. Bonds5

About 2-amino-N-(3,3-dimethylbutyl)pentanamide

2-amino-N-(3,3-dimethylbutyl)pentanamide (PubChem CID 112687728) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 2-amino-N-(3,3-dimethylbutyl)pentanamide.

Molecular Properties

Compound Name2-amino-N-(3,3-dimethylbutyl)pentanamide
PubChem CID112687728
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name2-amino-N-(3,3-dimethylbutyl)pentanamide
SMILESCCCC(N)C(=O)NCCC(C)(C)C
InChIInChI=1S/C11H24N2O/c1-5-6-9(12)10(14)13-8-7-11(2,3)4/h9H,5-8,12H2,1-4H3,(H,13,14)
InChIKeyBDTIXHNLOJQWMT-UHFFFAOYSA-N
XLogP1.67
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-propylpentanamide
CID 43649977
(2S)-2-amino-N-(2-hydroxyethyl)pentanamide
CID 89064333
(2R)-2-amino-N-butylpentanamide
CID 82668431
(2R)-2-amino-N-(5,5-dimethylhexyl)heptanamide
CID 90320269
2-amino-N-(3,3-dimethylbutyl)pent-4-enamide
CID 112704204
(2S)-2-amino-N-(3,3-dimethylbutyl)-3,3-dimethylbutanamide
CID 103808439
(2S)-2-amino-N-(5-hydroxypentyl)pentanamide
CID 107571012
2-amino-N-(5-methylhexyl)pentanamide
CID 81433782
(2S)-2-amino-N-(5-amino-5-oxopentyl)pentanamide
CID 106235890
(2S)-2-amino-N-(2-ethoxyethyl)pentanamide
CID 107568294
ethyl 2-[[(2S)-2-aminopentanoyl]amino]acetate
CID 107568770
4-[2-[[(2R)-2-aminopentanoyl]amino]ethyl]-5,5-dimethylhexanoic acid
CID 107569825

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,3-dimethylbutyl)pentanamide?
The IUPAC name of 2-amino-N-(3,3-dimethylbutyl)pentanamide (CID 112687728) is 2-amino-N-(3,3-dimethylbutyl)pentanamide.
What is the SMILES notation for 2-amino-N-(3,3-dimethylbutyl)pentanamide?
The canonical SMILES for 2-amino-N-(3,3-dimethylbutyl)pentanamide is CCCC(N)C(=O)NCCC(C)(C)C.
What is the InChIKey of 2-amino-N-(3,3-dimethylbutyl)pentanamide?
The InChIKey is BDTIXHNLOJQWMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-5-6-9(12)10(14)13-8-7-11(2,3)4/h9H,5-8,12H2,1-4H3,(H,13,14).
What are the key properties of 2-amino-N-(3,3-dimethylbutyl)pentanamide?
2-amino-N-(3,3-dimethylbutyl)pentanamide has a molecular weight of 200.33 g/mol, XLogP of 1.67, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,3-dimethylbutyl)pentanamide is sourced from PubChem (CID 112687728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).