N-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide

C11H24N2O — CID 106356922

IUPACN-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide
SMILESCCC(C)C(=O)NC(CCN)C(C)C
InChIInChI=1S/C11H24N2O/c1-5-9(4)11(14)13-10(6-7-12)8(2)3/h8-10H,5-7,12H2,1-4H3,(H,13,14)
InChIKeyXNIIDVQVILNSHK-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.52
Rot. Bonds6

About N-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide

N-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide (PubChem CID 106356922) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is N-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide.

Molecular Properties

Compound NameN-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide
PubChem CID106356922
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC NameN-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide
SMILESCCC(C)C(=O)NC(CCN)C(C)C
InChIInChI=1S/C11H24N2O/c1-5-9(4)11(14)13-10(6-7-12)8(2)3/h8-10H,5-7,12H2,1-4H3,(H,13,14)
InChIKeyXNIIDVQVILNSHK-UHFFFAOYSA-N
XLogP1.52
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-bromo-4-methylpentan-3-yl)-2-methylbutanamide
CID 106355055
N-(1-amino-4-methylpentan-3-yl)-2-phenylbutanamide
CID 106356833
N-(1-amino-4-methylpentan-3-yl)-2,2-dimethylbutanamide
CID 106356781
4-amino-2-methyl-N-propan-2-ylbutanamide
CID 80541541
6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide
CID 114176914
2-[(4-amino-2-methylbutanoyl)amino]-3-methylpentanoic acid
CID 80543638
5-amino-N-butan-2-yl-2-methylpentanamide
CID 112515136
N-[(2R)-butan-2-yl]-2-methylbutanamide
CID 88542995
N-(1-amino-4-methylpentan-3-yl)-4-ethylbenzamide
CID 106356762
N-(1-amino-4-methylpentan-3-yl)-2,4,5-trimethylfuran-3-carboxamide
CID 106356736
(2S)-2-[(4-amino-2-methylbutanoyl)amino]pentanoic acid
CID 107565180
3-amino-N-(2-methylpentan-3-yl)propanamide
CID 61472687

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide?
The IUPAC name of N-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide (CID 106356922) is N-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide.
What is the SMILES notation for N-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide?
The canonical SMILES for N-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide is CCC(C)C(=O)NC(CCN)C(C)C.
What is the InChIKey of N-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide?
The InChIKey is XNIIDVQVILNSHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-5-9(4)11(14)13-10(6-7-12)8(2)3/h8-10H,5-7,12H2,1-4H3,(H,13,14).
What are the key properties of N-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide?
N-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide has a molecular weight of 200.33 g/mol, XLogP of 1.52, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-4-methylpentan-3-yl)-2-methylbutanamide is sourced from PubChem (CID 106356922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).