(3R)-3-amino-4,4-dimethylpentan-1-ol

C7H17NO — CID 50993691

IUPAC(3R)-3-amino-4,4-dimethylpentan-1-ol
SMILESCC(C)(C)[C@H](N)CCO
InChIInChI=1S/C7H17NO/c1-7(2,3)6(8)4-5-9/h6,9H,4-5,8H2,1-3H3/t6-/m1/s1
InChIKeyJMAOWDJEWXBRGR-ZCFIWIBFSA-N
MW131.22 g/mol
LogP0.74
Rot. Bonds2

About (3R)-3-amino-4,4-dimethylpentan-1-ol

(3R)-3-amino-4,4-dimethylpentan-1-ol (PubChem CID 50993691) has the molecular formula C7H17NO and a molecular weight of 131.22 g/mol. Its IUPAC name is (3R)-3-amino-4,4-dimethylpentan-1-ol.

Molecular Properties

Compound Name(3R)-3-amino-4,4-dimethylpentan-1-ol
PubChem CID50993691
Molecular FormulaC7H17NO
Molecular Weight131.22 g/mol
Exact Mass131.13
IUPAC Name(3R)-3-amino-4,4-dimethylpentan-1-ol
SMILESCC(C)(C)[C@H](N)CCO
InChIInChI=1S/C7H17NO/c1-7(2,3)6(8)4-5-9/h6,9H,4-5,8H2,1-3H3/t6-/m1/s1
InChIKeyJMAOWDJEWXBRGR-ZCFIWIBFSA-N
XLogP0.74
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.22
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (3R)-3-amino-4,4-dimethylpentan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-Amino-3,3-dimethyl-1-butanol
CID 2734079
5-Amino-2,2-dimethylpentanol
CID 139489
2-Amino-3,3-dimethylbutan-1-ol
CID 4149212
(2R)-2-Amino-3,3-dimethylbutan-1-ol
CID 6932847
2-Amino-4,4-dimethylpentan-1-ol
CID 22102263
3-Amino-4-methyl-pentan-1-ol
CID 17039429
3-Amino-2-methylpentan-1-ol
CID 19890526
3-Amino-2,2,4-trimethylpentan-1-ol
CID 20384478
3-Amino-4,4-dimethylpentan-1-ol
CID 23660604
3-Amino-2,2-dimethylbutan-1-ol
CID 55290158
3-Amino-2,2-dimethylbutan-1-ol hydrochloride
CID 132371558
2-Amino-3,3-dimethylbutan-1-ol hydrochloride
CID 23083987

Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-4,4-dimethylpentan-1-ol?
The IUPAC name of (3R)-3-amino-4,4-dimethylpentan-1-ol (CID 50993691) is (3R)-3-amino-4,4-dimethylpentan-1-ol.
What is the SMILES notation for (3R)-3-amino-4,4-dimethylpentan-1-ol?
The canonical SMILES for (3R)-3-amino-4,4-dimethylpentan-1-ol is CC(C)(C)[C@H](N)CCO.
What is the InChIKey of (3R)-3-amino-4,4-dimethylpentan-1-ol?
The InChIKey is JMAOWDJEWXBRGR-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H17NO/c1-7(2,3)6(8)4-5-9/h6,9H,4-5,8H2,1-3H3/t6-/m1/s1.
What are the key properties of (3R)-3-amino-4,4-dimethylpentan-1-ol?
(3R)-3-amino-4,4-dimethylpentan-1-ol has a molecular weight of 131.22 g/mol, XLogP of 0.74, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-4,4-dimethylpentan-1-ol is sourced from PubChem (CID 50993691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).