(1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol

C7H15NO — CID 99995754

IUPAC(1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol
SMILESC[C@@H]1C[C@@](C)(N)C[C@@H]1O
InChIInChI=1S/C7H15NO/c1-5-3-7(2,8)4-6(5)9/h5-6,9H,3-4,8H2,1-2H3/t5-,6+,7-/m1/s1
InChIKeyPZQMNVJWQFMTEI-DSYKOEDSSA-N
MW129.20 g/mol
LogP0.49
Rot. Bonds

About (1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol

(1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol (PubChem CID 99995754) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is (1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol.

Molecular Properties

Compound Name(1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol
PubChem CID99995754
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name(1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol
SMILESC[C@@H]1C[C@@](C)(N)C[C@@H]1O
InChIInChI=1S/C7H15NO/c1-5-3-7(2,8)4-6(5)9/h5-6,9H,3-4,8H2,1-2H3/t5-,6+,7-/m1/s1
InChIKeyPZQMNVJWQFMTEI-DSYKOEDSSA-N
XLogP0.49
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1R,3R,4R)-1,4-dimethylcyclopentane-1,3-diamine
CID 124747898
(1S,3S,4R)-1,3,4-trimethylcyclohexan-1-amine
CID 124508954
1,3,5-trimethylcyclohexan-1-amine;hydrochloride
CID 18783158
trans-(1R,4S)-1,3-dimethylcyclohexane-1,4-diol
CID 102278367
5-amino-5-(hydroxymethyl)-2-methylcyclohexan-1-ol
CID 165490955
(4R,5S)-1,2,2,5-tetramethylpiperidin-4-ol
CID 7282558
trans-(1S,2S)-2-methylcyclopropan-1-ol
CID 13410812
(1S,2R,4R,6R)-4,6-dimethylcyclohexane-1,2,4-triol
CID 142953228
7-amino-3,7-dimethylbicyclo[3.3.1]nonan-3-ol
CID 123493909
(1S,2S,5R,6R)-4,4,6-trimethylbicyclo[3.1.0]hexan-2-ol
CID 54495644
(1S,1'S,2'S,3R,4R)-3-amino-2'-methylspiro[bicyclo[2.2.1]heptane-2,4'-cyclopentane]-1'-ol
CID 164833743
(1S,3R,4S)-4-methyl-1-propan-2-ylcyclohexane-1,3-diol
CID 130992035

Frequently Asked Questions

What is the IUPAC name of (1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol?
The IUPAC name of (1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol (CID 99995754) is (1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol.
What is the SMILES notation for (1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol?
The canonical SMILES for (1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol is C[C@@H]1C[C@@](C)(N)C[C@@H]1O.
What is the InChIKey of (1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol?
The InChIKey is PZQMNVJWQFMTEI-DSYKOEDSSA-N. The full InChI is InChI=1S/C7H15NO/c1-5-3-7(2,8)4-6(5)9/h5-6,9H,3-4,8H2,1-2H3/t5-,6+,7-/m1/s1.
What are the key properties of (1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol?
(1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol has a molecular weight of 129.20 g/mol, XLogP of 0.49, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2R,4R)-4-amino-2,4-dimethylcyclopentan-1-ol is sourced from PubChem (CID 99995754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).