3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol

C15H30N2O — CID 103358517

IUPAC3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol
SMILESCNCC1(CN2CCC(C)(O)C2)CCCC(C)C1
InChIInChI=1S/C15H30N2O/c1-13-5-4-6-15(9-13,10-16-3)12-17-8-7-14(2,18)11-17/h13,16,18H,4-12H2,1-3H3
InChIKeyMBPIDBUBIRGJJP-UHFFFAOYSA-N
MW254.42 g/mol
LogP1.86
Rot. Bonds4

About 3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol

3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol (PubChem CID 103358517) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol.

Molecular Properties

Compound Name3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol
PubChem CID103358517
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol
SMILESCNCC1(CN2CCC(C)(O)C2)CCCC(C)C1
InChIInChI=1S/C15H30N2O/c1-13-5-4-6-15(9-13,10-16-3)12-17-8-7-14(2,18)11-17/h13,16,18H,4-12H2,1-3H3
InChIKeyMBPIDBUBIRGJJP-UHFFFAOYSA-N
XLogP1.86
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-[(3-methoxypyrrolidin-1-yl)methyl]-3-methylcyclohexyl]-N-methylmethanamine
CID 103538925
1-[1-(2,3,3a,4,5,6,7,7a-octahydroindol-1-ylmethyl)-3-methylcyclohexyl]-N-methylmethanamine
CID 82751322
1-[[1-(hydroxymethyl)cycloheptyl]methyl]-3-methylpyrrolidin-3-ol
CID 103358661
3-methyl-1-[[1-[(2-methylpropylamino)methyl]cyclopentyl]methyl]pyrrolidin-3-ol
CID 103358631
N-methyl-1-[1-[(3-methylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine
CID 62256723
1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol
CID 114953469
5-[(dimethylamino)methyl]-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol
CID 66052929
[1-[[3-methyl-1-[(propan-2-ylamino)methyl]cyclohexyl]methyl]pyrrolidin-3-yl]methanol
CID 115967160
[1-[[1-[(cyclopropylamino)methyl]-3-methylcyclohexyl]methyl]pyrrolidin-3-yl]methanol
CID 115967181
1-[[1-(2-aminoethyl)cyclopropyl]methyl]-3-methylpyrrolidin-3-ol
CID 103355608
3-methyl-1-[[1-(methylaminomethyl)cyclopentyl]methyl]piperidin-4-ol
CID 114682011
N-[[1-[(3-methoxypiperidin-1-yl)methyl]-3-methylcyclohexyl]methyl]cyclopropanamine
CID 102967366

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol?
The IUPAC name of 3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol (CID 103358517) is 3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol.
What is the SMILES notation for 3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol?
The canonical SMILES for 3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol is CNCC1(CN2CCC(C)(O)C2)CCCC(C)C1.
What is the InChIKey of 3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol?
The InChIKey is MBPIDBUBIRGJJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-13-5-4-6-15(9-13,10-16-3)12-17-8-7-14(2,18)11-17/h13,16,18H,4-12H2,1-3H3.
What are the key properties of 3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol?
3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol has a molecular weight of 254.42 g/mol, XLogP of 1.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol is sourced from PubChem (CID 103358517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).