3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol

C14H30N2O — CID 62614618

IUPAC3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol
SMILESCNC1CCCCC1CN(CCCO)C(C)C
InChIInChI=1S/C14H30N2O/c1-12(2)16(9-6-10-17)11-13-7-4-5-8-14(13)15-3/h12-15,17H,4-11H2,1-3H3
InChIKeyOXCSMCXGKIRTDR-UHFFFAOYSA-N
MW242.41 g/mol
LogP1.86
Rot. Bonds7

About 3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol

3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol (PubChem CID 62614618) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol.

Molecular Properties

Compound Name3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol
PubChem CID62614618
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol
SMILESCNC1CCCCC1CN(CCCO)C(C)C
InChIInChI=1S/C14H30N2O/c1-12(2)16(9-6-10-17)11-13-7-4-5-8-14(13)15-3/h12-15,17H,4-11H2,1-3H3
InChIKeyOXCSMCXGKIRTDR-UHFFFAOYSA-N
XLogP1.86
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol with MolForge

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Related Compounds

3-[[2-(ethylamino)cyclopentyl]methyl-propan-2-ylamino]propan-1-ol
CID 62610037
2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol
CID 102870950
N-methyl-2-[2-[pentyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine
CID 79565802
2-[2,2-difluoroethyl-[[2-(methylamino)cycloheptyl]methyl]amino]ethanol
CID 107486535
2-[[1-cyclopropylethyl(2-methoxyethyl)amino]methyl]-N-methylcyclohexan-1-amine
CID 55093831
2-[[benzyl(propan-2-yl)amino]methyl]-N-methylcyclopentan-1-amine
CID 55094082
2-[[2-hydroxyethyl(propan-2-yl)amino]methyl]cyclopentan-1-ol
CID 62610119
N-methyl-2-[[propan-2-yl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-amine
CID 55094707
butan-1-ol;2-butyl-N-methylcycloheptan-1-amine
CID 71071246
N,N,N'-triethyl-N'-[[2-(methylamino)cyclohexyl]methyl]propane-1,3-diamine
CID 102997195
2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-N-methylcycloheptan-1-amine
CID 62611410
N-methyl-2-[[pentyl(propan-2-yl)amino]methyl]-4-propan-2-ylcyclohexan-1-amine
CID 63495395

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol?
The IUPAC name of 3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol (CID 62614618) is 3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol.
What is the SMILES notation for 3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol?
The canonical SMILES for 3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol is CNC1CCCCC1CN(CCCO)C(C)C.
What is the InChIKey of 3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol?
The InChIKey is OXCSMCXGKIRTDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-12(2)16(9-6-10-17)11-13-7-4-5-8-14(13)15-3/h12-15,17H,4-11H2,1-3H3.
What are the key properties of 3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol?
3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol has a molecular weight of 242.41 g/mol, XLogP of 1.86, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(methylamino)cyclohexyl]methyl-propan-2-ylamino]propan-1-ol is sourced from PubChem (CID 62614618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).