[3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol

C13H26N2O — CID 79646760

IUPAC[3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol
SMILESCNC1(CO)CCC(N2CC(C)C(C)C2)C1
InChIInChI=1S/C13H26N2O/c1-10-7-15(8-11(10)2)12-4-5-13(6-12,9-16)14-3/h10-12,14,16H,4-9H2,1-3H3
InChIKeyQRKCWVXIEOZATD-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.08
Rot. Bonds3

About [3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol

[3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol (PubChem CID 79646760) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is [3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol
PubChem CID79646760
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name[3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol
SMILESCNC1(CO)CCC(N2CC(C)C(C)C2)C1
InChIInChI=1S/C13H26N2O/c1-10-7-15(8-11(10)2)12-4-5-13(6-12,9-16)14-3/h10-12,14,16H,4-9H2,1-3H3
InChIKeyQRKCWVXIEOZATD-UHFFFAOYSA-N
XLogP1.08
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(methylamino)-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclopentyl]methanol
CID 79644724
[3-(2,2-dimethylmorpholin-4-yl)-1-(methylamino)cyclopentyl]methanol
CID 79656046
[3-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)-1-(methylamino)cyclopentyl]methanol
CID 81205829
[3-(3,5-dimethylpiperidin-1-yl)-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79656843
[1-(methylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol
CID 79645487
[3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride
CID 155895170
[8-methyl-3-(methylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol
CID 61054110
[1-(methylamino)-3-(2-methyl-1,4-oxazepan-4-yl)cyclohexyl]methanol
CID 79635369
[3-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-1-(methylamino)cyclopentyl]methanol
CID 79656071
[3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclohexyl]methanol
CID 79633930
[1-(methylamino)-3-(2-propylimidazol-1-yl)cyclopentyl]methanol
CID 79644477
[3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol
CID 79656827

Frequently Asked Questions

What is the IUPAC name of [3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol?
The IUPAC name of [3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol (CID 79646760) is [3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol.
What is the SMILES notation for [3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol?
The canonical SMILES for [3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol is CNC1(CO)CCC(N2CC(C)C(C)C2)C1.
What is the InChIKey of [3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol?
The InChIKey is QRKCWVXIEOZATD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-10-7-15(8-11(10)2)12-4-5-13(6-12,9-16)14-3/h10-12,14,16H,4-9H2,1-3H3.
What are the key properties of [3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol?
[3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol has a molecular weight of 226.36 g/mol, XLogP of 1.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol is sourced from PubChem (CID 79646760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).