2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol

C12H23NO — CID 130555925

IUPAC2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol
SMILESCC1(C)CCC1NC1CCCC1(C)O
InChIInChI=1S/C12H23NO/c1-11(2)8-6-9(11)13-10-5-4-7-12(10,3)14/h9-10,13-14H,4-8H2,1-3H3
InChIKeyZRACOXSIUXDAPT-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.07
Rot. Bonds2

About 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol

2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol (PubChem CID 130555925) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol.

Molecular Properties

Compound Name2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol
PubChem CID130555925
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol
SMILESCC1(C)CCC1NC1CCCC1(C)O
InChIInChI=1S/C12H23NO/c1-11(2)8-6-9(11)13-10-5-4-7-12(10,3)14/h9-10,13-14H,4-8H2,1-3H3
InChIKeyZRACOXSIUXDAPT-UHFFFAOYSA-N
XLogP2.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-Methyl-2-(methylamino)cyclopentan-1-ol
CID 67051509
trans-(1S,2R)-2-(2-methylpropylamino)-1-(trifluoromethyl)cyclopentan-1-ol
CID 167273949
trans-(1S,2R)-2-(tert-butylamino)-1-methylcyclopentan-1-ol
CID 134992791
2-(2-Fluoroethylamino)-1-methylcyclopentan-1-ol
CID 126979136
1-Methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol
CID 130532216
2-(3,3-Difluorobutan-2-ylamino)-1-methylcyclopentan-1-ol
CID 130908915
2-[(3,3-Difluorocyclobutyl)amino]-1-methylcyclopentan-1-ol
CID 164650724
2-[(2,2-Difluoropropyl)amino]-1-methylcyclopentan-1-ol
CID 164654639
1-{[(Propan-2-yl)amino]methyl}cyclopentan-1-ol
CID 62772563
3-[(1S)-1-[(2-hydroxy-2-methylcyclopentyl)amino]ethyl]azetidin-3-ol
CID 69272605
(1R)-1-methyl-2-(methylamino)cyclopentan-1-ol
CID 90981003
(1S)-1-methyl-2-(methylamino)cyclopentan-1-ol
CID 91025193

Frequently Asked Questions

What is the IUPAC name of 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol?
The IUPAC name of 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol (CID 130555925) is 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol.
What is the SMILES notation for 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol?
The canonical SMILES for 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol is CC1(C)CCC1NC1CCCC1(C)O.
What is the InChIKey of 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol?
The InChIKey is ZRACOXSIUXDAPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-11(2)8-6-9(11)13-10-5-4-7-12(10,3)14/h9-10,13-14H,4-8H2,1-3H3.
What are the key properties of 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol?
2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol has a molecular weight of 197.32 g/mol, XLogP of 2.07, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol is sourced from PubChem (CID 130555925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).