[3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol

C12H25NO — CID 80699594

IUPAC[3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol
SMILESCC(C)CNC1(CO)CCC(C)(C)C1
InChIInChI=1S/C12H25NO/c1-10(2)7-13-12(9-14)6-5-11(3,4)8-12/h10,13-14H,5-9H2,1-4H3
InChIKeyXIIWSMRJPFXYMY-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.17
Rot. Bonds4

About [3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol

[3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol (PubChem CID 80699594) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is [3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol
PubChem CID80699594
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name[3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol
SMILESCC(C)CNC1(CO)CCC(C)(C)C1
InChIInChI=1S/C12H25NO/c1-10(2)7-13-12(9-14)6-5-11(3,4)8-12/h10,13-14H,5-9H2,1-4H3
InChIKeyXIIWSMRJPFXYMY-UHFFFAOYSA-N
XLogP2.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[3-Methyl-1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol
CID 64515982
[3-Ethyl-1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol
CID 64515983
[3,3-Dimethyl-1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol
CID 80699828
[2,4,4-Trimethyl-1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol
CID 106663998
[1-[(2-Methylcyclopentyl)amino]cyclopentyl]methanol
CID 18315975
(4-Tert-butylpyrrolidin-2-yl)methanol
CID 20792997
({[(3-Methylbutyl)amino]methyl}cyclopentyl)methan-1-ol
CID 22736527
[1-(Ethylamino)cyclopentyl]methanol
CID 23396934
[1-(Butylamino)cyclopentyl]methanol
CID 57567662
1-[(1-Methylethyl)amino]cyclopentanemethanol
CID 58866368
[3-[(Tert-butylamino)methyl]cyclopentyl]methanol
CID 59314593
[3-[(Propan-2-ylamino)methyl]cyclopentyl]methanol
CID 59515607

Frequently Asked Questions

What is the IUPAC name of [3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol?
The IUPAC name of [3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol (CID 80699594) is [3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol.
What is the SMILES notation for [3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol?
The canonical SMILES for [3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol is CC(C)CNC1(CO)CCC(C)(C)C1.
What is the InChIKey of [3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol?
The InChIKey is XIIWSMRJPFXYMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-10(2)7-13-12(9-14)6-5-11(3,4)8-12/h10,13-14H,5-9H2,1-4H3.
What are the key properties of [3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol?
[3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol has a molecular weight of 199.34 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3,3-dimethyl-1-(2-methylpropylamino)cyclopentyl]methanol is sourced from PubChem (CID 80699594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).