[2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol

C12H25NO — CID 115655345

IUPAC[2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol
SMILESCC(C)(C)CNC1CCCC1(C)CO
InChIInChI=1S/C12H25NO/c1-11(2,3)8-13-10-6-5-7-12(10,4)9-14/h10,13-14H,5-9H2,1-4H3
InChIKeyPHBRAIBNPDKFSQ-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.17
Rot. Bonds3

About [2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol

[2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol (PubChem CID 115655345) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is [2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol.

Molecular Properties

Compound Name[2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol
PubChem CID115655345
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name[2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol
SMILESCC(C)(C)CNC1CCCC1(C)CO
InChIInChI=1S/C12H25NO/c1-11(2,3)8-13-10-6-5-7-12(10,4)9-14/h10,13-14H,5-9H2,1-4H3
InChIKeyPHBRAIBNPDKFSQ-UHFFFAOYSA-N
XLogP2.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
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

1-[2-(hydroxymethyl)-2-methylcyclopentyl]-3-(2-methoxy-2-methylpropyl)urea
CID 111508607
[(1S,2S)-2-[[(1R)-cyclohex-3-en-1-yl]methylamino]-1-methylcyclopentyl]methanol
CID 97240106
1-(2,2-dimethylcyclopentyl)-3-[2-(hydroxymethyl)-2-methylcyclopentyl]urea
CID 111841148
3-[(2,2-dimethylcyclopentyl)amino]-2,2-dimethylpropanoic acid
CID 79870141
[2-[(5-chlorofuran-2-yl)methylamino]-1-methylcyclopentyl]methanol
CID 115655341
[(1R,2S)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylamino]-1-methylcyclopentyl]methanol
CID 99792094
2,2-difluoro-2-(1-hydroxycyclobutyl)-N-[2-(hydroxymethyl)-2-methylcyclopentyl]acetamide
CID 75436732
(1,2-dimethylcyclopentyl)methanol
CID 544196
[(1S,2R)-1,2-dimethylcyclopentyl]methanol
CID 167089966
[2-(hexan-3-ylamino)-1-methylcyclopentyl]methanol
CID 115905963
1-cyclohexyl-3-[2-(hydroxymethyl)-2-methylcyclopentyl]urea
CID 111470878
[2-[(5-bromothiophen-3-yl)methylamino]-1-methylcyclopentyl]methanol
CID 111468945

Frequently Asked Questions

What is the IUPAC name of [2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol?
The IUPAC name of [2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol (CID 115655345) is [2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol.
What is the SMILES notation for [2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol?
The canonical SMILES for [2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol is CC(C)(C)CNC1CCCC1(C)CO.
What is the InChIKey of [2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol?
The InChIKey is PHBRAIBNPDKFSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-11(2,3)8-13-10-6-5-7-12(10,4)9-14/h10,13-14H,5-9H2,1-4H3.
What are the key properties of [2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol?
[2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol has a molecular weight of 199.34 g/mol, XLogP of 2.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol is sourced from PubChem (CID 115655345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).