2-(aminomethyl)-N,2-dimethylbutanamide

C7H16N2O — CID 114290214

IUPAC2-(aminomethyl)-N,2-dimethylbutanamide
SMILESCCC(C)(CN)C(=O)NC
InChIInChI=1S/C7H16N2O/c1-4-7(2,5-8)6(10)9-3/h4-5,8H2,1-3H3,(H,9,10)
InChIKeyKJTVPGRUUYXSHI-UHFFFAOYSA-N
MW144.22 g/mol
LogP0.11
Rot. Bonds3

About 2-(aminomethyl)-N,2-dimethylbutanamide

2-(aminomethyl)-N,2-dimethylbutanamide (PubChem CID 114290214) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is 2-(aminomethyl)-N,2-dimethylbutanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N,2-dimethylbutanamide
PubChem CID114290214
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name2-(aminomethyl)-N,2-dimethylbutanamide
SMILESCCC(C)(CN)C(=O)NC
InChIInChI=1S/C7H16N2O/c1-4-7(2,5-8)6(10)9-3/h4-5,8H2,1-3H3,(H,9,10)
InChIKeyKJTVPGRUUYXSHI-UHFFFAOYSA-N
XLogP0.11
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(aminomethyl)-N-ethyl-2-methylbutanamide
CID 114290216
2-(aminomethyl)-2-methyl-N-(2,2,2-trifluoroethyl)butanamide
CID 114290297
2-(aminomethyl)-2-methyl-N-(3-methyl-2-propan-2-ylbutyl)butanamide
CID 102904797
3-amino-N,2,2-trimethylpropanamide;hydrochloride
CID 22364426
2-(aminomethyl)-N-(2-methoxyethyl)-2-methylbutanamide
CID 114290208
2-(aminomethyl)-N-(2,2-dimethylcyclopropyl)-2-methylbutanamide
CID 114290587
2-(aminomethyl)-N-(2-ethoxy-2-methylpropyl)-2-methylbutanamide
CID 114941575
N-(4-acetamidophenyl)-2-(aminomethyl)-2-methylbutanamide
CID 114290300
2-hydroxy-N,2-dimethylbutanamide
CID 22213750
3-chloro-2-(chloromethyl)-N,2-dimethylpropanamide
CID 137333173
2-(aminomethyl)-2-methyl-N-(2-propan-2-yloxyethyl)butanamide
CID 104759857
5-(aminomethyl)-1,1,1-trifluoro-5-methylheptan-4-one
CID 116611006

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N,2-dimethylbutanamide?
The IUPAC name of 2-(aminomethyl)-N,2-dimethylbutanamide (CID 114290214) is 2-(aminomethyl)-N,2-dimethylbutanamide.
What is the SMILES notation for 2-(aminomethyl)-N,2-dimethylbutanamide?
The canonical SMILES for 2-(aminomethyl)-N,2-dimethylbutanamide is CCC(C)(CN)C(=O)NC.
What is the InChIKey of 2-(aminomethyl)-N,2-dimethylbutanamide?
The InChIKey is KJTVPGRUUYXSHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-4-7(2,5-8)6(10)9-3/h4-5,8H2,1-3H3,(H,9,10).
What are the key properties of 2-(aminomethyl)-N,2-dimethylbutanamide?
2-(aminomethyl)-N,2-dimethylbutanamide has a molecular weight of 144.22 g/mol, XLogP of 0.11, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N,2-dimethylbutanamide is sourced from PubChem (CID 114290214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).