(3R)-3-amino-3-methylpentan-1-ol

C6H15NO — CID 46840162

IUPAC(3R)-3-amino-3-methylpentan-1-ol
SMILESCC[C@@](C)(N)CCO
InChIInChI=1S/C6H15NO/c1-3-6(2,7)4-5-8/h8H,3-5,7H2,1-2H3/t6-/m1/s1
InChIKeyWIKUCGJLELHSGA-ZCFIWIBFSA-N
MW117.19 g/mol
LogP0.50
Rot. Bonds3

About (3R)-3-amino-3-methylpentan-1-ol

(3R)-3-amino-3-methylpentan-1-ol (PubChem CID 46840162) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is (3R)-3-amino-3-methylpentan-1-ol.

Molecular Properties

Compound Name(3R)-3-amino-3-methylpentan-1-ol
PubChem CID46840162
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC Name(3R)-3-amino-3-methylpentan-1-ol
SMILESCC[C@@](C)(N)CCO
InChIInChI=1S/C6H15NO/c1-3-6(2,7)4-5-8/h8H,3-5,7H2,1-2H3/t6-/m1/s1
InChIKeyWIKUCGJLELHSGA-ZCFIWIBFSA-N
XLogP0.50
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Tris(Hydroxyethyl)Aminomethane
CID 448009
3-Amino-3-methylbutan-1-ol
CID 641000
[1,5-Dihydroxy-3-(2-hydroxyethyl)pentan-3-yl]azanium
CID 22480641
2-Amino-2-methylbutan-1-ol
CID 10154017
3-Amino-3-ethylpentan-1-ol
CID 16205007
4-Amino-4-methylpentan-1-ol
CID 13107682
2-Amino-2-ethylbutan-1-ol
CID 14325607
2-(1-Aminocyclopropyl)ethan-1-ol hydrochloride
CID 20072991
3-Amino-3-methylpentan-1-ol
CID 20376797
2-Amino-2-methylpentan-1-ol
CID 15008405
(2S)-2-Amino-2-methylbutan-1-ol
CID 42579762
2-(1-Aminocyclopropyl)ethanol
CID 12993138

Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-3-methylpentan-1-ol?
The IUPAC name of (3R)-3-amino-3-methylpentan-1-ol (CID 46840162) is (3R)-3-amino-3-methylpentan-1-ol.
What is the SMILES notation for (3R)-3-amino-3-methylpentan-1-ol?
The canonical SMILES for (3R)-3-amino-3-methylpentan-1-ol is CC[C@@](C)(N)CCO.
What is the InChIKey of (3R)-3-amino-3-methylpentan-1-ol?
The InChIKey is WIKUCGJLELHSGA-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H15NO/c1-3-6(2,7)4-5-8/h8H,3-5,7H2,1-2H3/t6-/m1/s1.
What are the key properties of (3R)-3-amino-3-methylpentan-1-ol?
(3R)-3-amino-3-methylpentan-1-ol has a molecular weight of 117.19 g/mol, XLogP of 0.50, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-3-methylpentan-1-ol is sourced from PubChem (CID 46840162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).