2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol

C11H22N2O — CID 103576741

IUPAC2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol
SMILESCC1CN(C2CCCCC2O)CC1N
InChIInChI=1S/C11H22N2O/c1-8-6-13(7-9(8)12)10-4-2-3-5-11(10)14/h8-11,14H,2-7,12H2,1H3
InChIKeyHCCVBAGBWALQHQ-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.57
Rot. Bonds1

About 2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol

2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol (PubChem CID 103576741) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol
PubChem CID103576741
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol
SMILESCC1CN(C2CCCCC2O)CC1N
InChIInChI=1S/C11H22N2O/c1-8-6-13(7-9(8)12)10-4-2-3-5-11(10)14/h8-11,14H,2-7,12H2,1H3
InChIKeyHCCVBAGBWALQHQ-UHFFFAOYSA-N
XLogP0.57
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-1-(2-methylcyclohexyl)pyrrolidin-3-amine
CID 103575116
trans-(1S,2S)-2-(3,4-dimethylpiperidin-1-yl)cyclohexan-1-ol
CID 102732321
1-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-4-methylpyrrolidin-3-amine
CID 103575631
1-cyclooctyl-4-methylpyrrolidin-3-amine
CID 103575307
1-(2-hydroxycyclopentyl)-4-methylpyrrolidine-3-carboxylic acid
CID 63721763
2-[3-(aminomethyl)-4-methylpiperidin-1-yl]cyclopentan-1-ol
CID 114961215
(3R,4S)-1-(2-hydroxycyclopentyl)pyrrolidine-3,4-diol
CID 115278432
2-(3,4-dimethylpyrrolidin-1-yl)cyclopentan-1-amine
CID 79188038
1-(2,4-dimethylcyclohexyl)-4-methylpyrrolidin-3-amine
CID 103575548
(3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine
CID 124709446
cis-(1R,2S)-2-(4-aminopiperidin-1-yl)cyclohexan-1-ol
CID 93346127
cis-(1S,2R)-2-pyrrolidin-1-ylcyclohexan-1-ol
CID 23656399

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol?
The IUPAC name of 2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol (CID 103576741) is 2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol.
What is the SMILES notation for 2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol?
The canonical SMILES for 2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol is CC1CN(C2CCCCC2O)CC1N.
What is the InChIKey of 2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol?
The InChIKey is HCCVBAGBWALQHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-8-6-13(7-9(8)12)10-4-2-3-5-11(10)14/h8-11,14H,2-7,12H2,1H3.
What are the key properties of 2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol?
2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol has a molecular weight of 198.31 g/mol, XLogP of 0.57, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol is sourced from PubChem (CID 103576741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).