2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide

C11H22N2O — CID 62860792

IUPAC2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide
SMILESCCC(CN)C(=O)N(C)CC1CCC1
InChIInChI=1S/C11H22N2O/c1-3-10(7-12)11(14)13(2)8-9-5-4-6-9/h9-10H,3-8,12H2,1-2H3
InChIKeyOXGGUDXOOCNFRJ-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.23
Rot. Bonds5

About 2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide

2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide (PubChem CID 62860792) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide
PubChem CID62860792
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide
SMILESCCC(CN)C(=O)N(C)CC1CCC1
InChIInChI=1S/C11H22N2O/c1-3-10(7-12)11(14)13(2)8-9-5-4-6-9/h9-10H,3-8,12H2,1-2H3
InChIKeyOXGGUDXOOCNFRJ-UHFFFAOYSA-N
XLogP1.23
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(aminomethyl)-N-(cyclobutylmethyl)-N,4,4-trimethylpentanamide
CID 107472079
2-(aminomethyl)-N-(cyclopropylmethyl)-N,4,4-trimethylpentanamide
CID 107471602
2-amino-N-(cyclobutylmethyl)-N,3-dimethylpentanamide
CID 62862218
(2R)-2-amino-N-(cyclobutylmethyl)-N-methylpentanamide
CID 103796269
2-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)butanamide
CID 62547118
(2S,3S)-2-amino-N-(cyclohexylmethyl)-N,3-dimethylpentanamide
CID 61162838
5-amino-N-(cyclobutylmethyl)-N,2-dimethylpentanamide
CID 104685012
1-(cyclobutylmethyl)-1-methylurea
CID 62860439
2-amino-N-(cyclobutylmethyl)-N-methylbutanediamide
CID 62861520
2-(aminomethyl)-N-cyclobutyl-N-(2-hydroxyethyl)butanamide
CID 102861278
3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide
CID 62878205
N-(cyclobutylmethyl)-N-methyl-2-(methylamino)propanamide
CID 62861176

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide?
The IUPAC name of 2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide (CID 62860792) is 2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide.
What is the SMILES notation for 2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide?
The canonical SMILES for 2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide is CCC(CN)C(=O)N(C)CC1CCC1.
What is the InChIKey of 2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide?
The InChIKey is OXGGUDXOOCNFRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-10(7-12)11(14)13(2)8-9-5-4-6-9/h9-10H,3-8,12H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide?
2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide has a molecular weight of 198.31 g/mol, XLogP of 1.23, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(cyclobutylmethyl)-N-methylbutanamide is sourced from PubChem (CID 62860792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).