1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol

C11H22N2O — CID 172599097

IUPAC1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol
SMILESCN(CC1(O)CC1)C1CCC(N)CC1
InChIInChI=1S/C11H22N2O/c1-13(8-11(14)6-7-11)10-4-2-9(12)3-5-10/h9-10,14H,2-8,12H2,1H3
InChIKeyRPMXCVQOYGSBGR-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.71
Rot. Bonds3

About 1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol

1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol (PubChem CID 172599097) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol
PubChem CID172599097
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol
SMILESCN(CC1(O)CC1)C1CCC(N)CC1
InChIInChI=1S/C11H22N2O/c1-13(8-11(14)6-7-11)10-4-2-9(12)3-5-10/h9-10,14H,2-8,12H2,1H3
InChIKeyRPMXCVQOYGSBGR-UHFFFAOYSA-N
XLogP0.71
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-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-[[(3-aminocyclohexyl)-methylamino]methyl]cyclopentan-1-ol
CID 114953874
4-N-(1-adamantylmethyl)-4-N-methylcyclohexane-1,4-diamine
CID 79113300
4-[amino(methyl)amino]cyclohexan-1-amine
CID 131970686
1-[[methyl-[4-(methylamino)cyclohexyl]amino]methyl]cyclohexan-1-ol
CID 79122134
1-[[cyclopropyl(methyl)amino]methyl]cyclopropan-1-amine
CID 65457489
1-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]cyclopentan-1-ol
CID 65212623
4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol
CID 55048858
4-N-methyl-4-N-(2-methylpropyl)cyclohexane-1,4-diamine
CID 62807255
1-[[methyl(oxetan-3-yl)amino]methyl]cyclopentan-1-ol
CID 131153818
4-[[azetidin-3-yl(methyl)amino]methyl]piperidin-4-ol
CID 126846975
4-N-(2-chloroprop-2-enyl)-4-N-methylcyclohexane-1,4-diamine
CID 79120943
4-[[cyclopropyl(methyl)amino]methyl]bicyclo[2.2.2]octan-1-amine
CID 139592833

Frequently Asked Questions

What is the IUPAC name of 1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol?
The IUPAC name of 1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol (CID 172599097) is 1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol?
The canonical SMILES for 1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol is CN(CC1(O)CC1)C1CCC(N)CC1.
What is the InChIKey of 1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol?
The InChIKey is RPMXCVQOYGSBGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-13(8-11(14)6-7-11)10-4-2-9(12)3-5-10/h9-10,14H,2-8,12H2,1H3.
What are the key properties of 1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol?
1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol has a molecular weight of 198.31 g/mol, XLogP of 0.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol is sourced from PubChem (CID 172599097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).