2-[butyl(methyl)amino]-3-methylbutanamide

C10H22N2O — CID 82040476

IUPAC2-[butyl(methyl)amino]-3-methylbutanamide
SMILESCCCCN(C)C(C(N)=O)C(C)C
InChIInChI=1S/C10H22N2O/c1-5-6-7-12(4)9(8(2)3)10(11)13/h8-9H,5-7H2,1-4H3,(H2,11,13)
InChIKeyLUBBWFMMHNXRTP-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.23
Rot. Bonds6

About 2-[butyl(methyl)amino]-3-methylbutanamide

2-[butyl(methyl)amino]-3-methylbutanamide (PubChem CID 82040476) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 2-[butyl(methyl)amino]-3-methylbutanamide.

Molecular Properties

Compound Name2-[butyl(methyl)amino]-3-methylbutanamide
PubChem CID82040476
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name2-[butyl(methyl)amino]-3-methylbutanamide
SMILESCCCCN(C)C(C(N)=O)C(C)C
InChIInChI=1S/C10H22N2O/c1-5-6-7-12(4)9(8(2)3)10(11)13/h8-9H,5-7H2,1-4H3,(H2,11,13)
InChIKeyLUBBWFMMHNXRTP-UHFFFAOYSA-N
XLogP1.23
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[butyl(methyl)amino]-3-methylbutanoyl chloride
CID 82040614
2-[butyl(methyl)amino]propanamide
CID 60644986
(2R)-3-methyl-2-[methyl(undecyl)amino]butanoic acid
CID 154125332
(2S)-2-[3-[ethyl(prop-2-enoyl)amino]propyl-methylamino]-3-methylbutanamide
CID 170208483
(2R)-2-(dimethylamino)-3-methylbutanamide;hydrochloride
CID 89440606
N-(3-amino-4-ethylphenyl)-2-[butyl(methyl)amino]-3-methylbutanamide
CID 82224974
2-amino-N-butyl-N-cyclopropyl-3-methylbutanamide
CID 60944592
methyl (2S)-2-[methyl(pentyl)amino]propanoate
CID 21097433
2-[3-(dimethylamino)propyl-methylamino]propanamide
CID 63698900
2-[butyl(2-hydroxyethyl)amino]-3-methylbutanehydrazide
CID 63585073
1-butyl-3-carbamoyl-1-methyl-3-propan-2-ylurea
CID 141134273
(2S)-2-amino-N,N-dibutyl-3-methylbutanamide
CID 28983163

Frequently Asked Questions

What is the IUPAC name of 2-[butyl(methyl)amino]-3-methylbutanamide?
The IUPAC name of 2-[butyl(methyl)amino]-3-methylbutanamide (CID 82040476) is 2-[butyl(methyl)amino]-3-methylbutanamide.
What is the SMILES notation for 2-[butyl(methyl)amino]-3-methylbutanamide?
The canonical SMILES for 2-[butyl(methyl)amino]-3-methylbutanamide is CCCCN(C)C(C(N)=O)C(C)C.
What is the InChIKey of 2-[butyl(methyl)amino]-3-methylbutanamide?
The InChIKey is LUBBWFMMHNXRTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-5-6-7-12(4)9(8(2)3)10(11)13/h8-9H,5-7H2,1-4H3,(H2,11,13).
What are the key properties of 2-[butyl(methyl)amino]-3-methylbutanamide?
2-[butyl(methyl)amino]-3-methylbutanamide has a molecular weight of 186.30 g/mol, XLogP of 1.23, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl(methyl)amino]-3-methylbutanamide is sourced from PubChem (CID 82040476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).