4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide

C10H22N2O — CID 80542110

IUPAC4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide
SMILESCC(C)CN(C)C(=O)C(C)CCN
InChIInChI=1S/C10H22N2O/c1-8(2)7-12(4)10(13)9(3)5-6-11/h8-9H,5-7,11H2,1-4H3
InChIKeyMMKFDOMIDQITIZ-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.09
Rot. Bonds5

About 4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide

4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide (PubChem CID 80542110) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide.

Molecular Properties

Compound Name4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide
PubChem CID80542110
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide
SMILESCC(C)CN(C)C(=O)C(C)CCN
InChIInChI=1S/C10H22N2O/c1-8(2)7-12(4)10(13)9(3)5-6-11/h8-9H,5-7,11H2,1-4H3
InChIKeyMMKFDOMIDQITIZ-UHFFFAOYSA-N
XLogP1.09
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide?
The IUPAC name of 4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide (CID 80542110) is 4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide.
What is the SMILES notation for 4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide?
The canonical SMILES for 4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide is CC(C)CN(C)C(=O)C(C)CCN.
What is the InChIKey of 4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide?
The InChIKey is MMKFDOMIDQITIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-8(2)7-12(4)10(13)9(3)5-6-11/h8-9H,5-7,11H2,1-4H3.
What are the key properties of 4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide?
4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide has a molecular weight of 186.30 g/mol, XLogP of 1.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,2-dimethyl-N-(2-methylpropyl)butanamide is sourced from PubChem (CID 80542110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).