1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol

C13H25NO — CID 65107657

IUPAC1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol
SMILESCC1CCC(NCC2(O)CCCCC2)C1
InChIInChI=1S/C13H25NO/c1-11-5-6-12(9-11)14-10-13(15)7-3-2-4-8-13/h11-12,14-15H,2-10H2,1H3
InChIKeyGYBFBHWOZYDAEK-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.46
Rot. Bonds3

About 1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol

1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol (PubChem CID 65107657) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol
PubChem CID65107657
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol
SMILESCC1CCC(NCC2(O)CCCCC2)C1
InChIInChI=1S/C13H25NO/c1-11-5-6-12(9-11)14-10-13(15)7-3-2-4-8-13/h11-12,14-15H,2-10H2,1H3
InChIKeyGYBFBHWOZYDAEK-UHFFFAOYSA-N
XLogP2.46
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethyl-1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol
CID 65116235
1-[[(3-ethylcyclopentyl)amino]methyl]cyclopentan-1-ol
CID 65105950
1-[(cyclobutylamino)methyl]cycloheptan-1-ol
CID 62416530
1-[(cycloheptylamino)methyl]cycloheptan-1-ol
CID 60710664
1-[(cyclopropylamino)methyl]-4-methylcycloheptan-1-ol
CID 65082633
1-[[(4-hydroxycyclohexyl)amino]methyl]cyclohexan-1-ol
CID 103625161
4-[(1-hydroxycyclopentyl)methylamino]cyclohexan-1-ol
CID 103881245
N-[(1-fluorocyclobutyl)methyl]-3-methylcyclopentan-1-amine
CID 130747190
1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol
CID 65105949
1-[[(5-methylthiolan-3-yl)amino]methyl]cyclohexan-1-ol
CID 79949972
3-[[(3-methylcyclohexyl)amino]methyl]thiolan-3-ol
CID 115672584
1-[[(3-aminocyclobutyl)amino]methyl]cycloheptan-1-ol
CID 80562089

Frequently Asked Questions

What is the IUPAC name of 1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol (CID 65107657) is 1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol is CC1CCC(NCC2(O)CCCCC2)C1.
What is the InChIKey of 1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol?
The InChIKey is GYBFBHWOZYDAEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-11-5-6-12(9-11)14-10-13(15)7-3-2-4-8-13/h11-12,14-15H,2-10H2,1H3.
What are the key properties of 1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol?
1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol has a molecular weight of 211.35 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 65107657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).