1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol

C14H27NO — CID 65105949

IUPAC1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol
SMILESCCC1CCCC(NCC2(O)CCCC2)C1
InChIInChI=1S/C14H27NO/c1-2-12-6-5-7-13(10-12)15-11-14(16)8-3-4-9-14/h12-13,15-16H,2-11H2,1H3
InChIKeyKXUNWFVIAHRHFA-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.85
Rot. Bonds4

About 1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol

1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol (PubChem CID 65105949) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol
PubChem CID65105949
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol
SMILESCCC1CCCC(NCC2(O)CCCC2)C1
InChIInChI=1S/C14H27NO/c1-2-12-6-5-7-13(10-12)15-11-14(16)8-3-4-9-14/h12-13,15-16H,2-11H2,1H3
InChIKeyKXUNWFVIAHRHFA-UHFFFAOYSA-N
XLogP2.85
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[(3-ethylcyclopentyl)amino]methyl]cyclopentan-1-ol
CID 65105950
1-[[(3-ethylcyclohexyl)amino]methyl]-4-methylcyclohexan-1-ol
CID 65115804
4-[[(3-ethylcyclohexyl)amino]methyl]oxan-4-ol
CID 79033062
1-[[(4-ethylcycloheptyl)amino]methyl]cyclohexan-1-ol
CID 65106934
3-[[(3-ethylcyclohexyl)amino]methyl]thiolan-3-ol
CID 111629673
4-ethyl-1-[[[3-(2-methylpropyl)cyclohexyl]amino]methyl]cyclohexan-1-ol
CID 107428536
1-[(cyclobutylamino)methyl]cycloheptan-1-ol
CID 62416530
1-[(cycloheptylamino)methyl]cycloheptan-1-ol
CID 60710664
4-methyl-1-[[[3-(2-methylpropyl)cyclohexyl]amino]methyl]cyclohexan-1-ol
CID 107428533
1-[[(3-aminocyclobutyl)amino]methyl]cycloheptan-1-ol
CID 80562089
1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol
CID 65107657
4-ethyl-1-[[(3-methylcyclopentyl)amino]methyl]cyclohexan-1-ol
CID 65116235

Frequently Asked Questions

What is the IUPAC name of 1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol (CID 65105949) is 1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol is CCC1CCCC(NCC2(O)CCCC2)C1.
What is the InChIKey of 1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol?
The InChIKey is KXUNWFVIAHRHFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-2-12-6-5-7-13(10-12)15-11-14(16)8-3-4-9-14/h12-13,15-16H,2-11H2,1H3.
What are the key properties of 1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol?
1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol has a molecular weight of 225.38 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(3-ethylcyclohexyl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 65105949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).