2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol

C11H22N2O — CID 61462250

IUPAC2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol
SMILESCN1CCC(NC2CCCCC2O)C1
InChIInChI=1S/C11H22N2O/c1-13-7-6-9(8-13)12-10-4-2-3-5-11(10)14/h9-12,14H,2-8H2,1H3
InChIKeyDRXHVZHEMXYNLX-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.58
Rot. Bonds2

About 2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol

2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol (PubChem CID 61462250) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol
PubChem CID61462250
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol
SMILESCN1CCC(NC2CCCCC2O)C1
InChIInChI=1S/C11H22N2O/c1-13-7-6-9(8-13)12-10-4-2-3-5-11(10)14/h9-12,14H,2-8H2,1H3
InChIKeyDRXHVZHEMXYNLX-UHFFFAOYSA-N
XLogP0.58
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-1-methyl-N-[(1S,2R)-2-methylcyclohexyl]pyrrolidin-3-amine
CID 124708701
1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine
CID 81344224
1-methyl-N-(2-methylcyclopentyl)pyrrolidin-3-amine
CID 63278241
2-[(1,3-dimethylpiperidin-4-yl)amino]cyclopentan-1-ol
CID 115891311
trans-(1R,2R)-2-(cyclopentylamino)cycloheptan-1-ol
CID 93383696
cis-(1S,2R)-2-(cyclobutylamino)cyclohexan-1-ol
CID 94414916
2-(cycloheptylamino)cyclopentan-1-ol
CID 60713716
trans-(1R,2R)-2-(cyclopropylamino)cyclopentan-1-ol
CID 92555045
4-[(2-hydroxycyclohexyl)amino]piperidine-1-carboxamide
CID 55064221
2-[[(1S,2S)-2-hydroxycyclohexyl]amino]cycloheptan-1-ol
CID 102731599
trans-(1R,2R)-2-(cyclopent-3-en-1-ylamino)cyclohexan-1-ol
CID 102731668
2-[(1,1-dioxothietan-3-yl)amino]cyclohexan-1-ol
CID 131160518

Frequently Asked Questions

What is the IUPAC name of 2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol?
The IUPAC name of 2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol (CID 61462250) is 2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol?
The canonical SMILES for 2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol is CN1CCC(NC2CCCCC2O)C1.
What is the InChIKey of 2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol?
The InChIKey is DRXHVZHEMXYNLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-13-7-6-9(8-13)12-10-4-2-3-5-11(10)14/h9-12,14H,2-8H2,1H3.
What are the key properties of 2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol?
2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol has a molecular weight of 198.31 g/mol, XLogP of 0.58, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 61462250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).