4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol

C13H27NO — CID 165497433

IUPAC4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol
SMILESCCC1CCC(O)CC1N(CC)C(C)C
InChIInChI=1S/C13H27NO/c1-5-11-7-8-12(15)9-13(11)14(6-2)10(3)4/h10-13,15H,5-9H2,1-4H3
InChIKeyQGJLEKYAHBYJTE-UHFFFAOYSA-N
MW213.37 g/mol
LogP2.66
Rot. Bonds4

About 4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol

4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol (PubChem CID 165497433) has the molecular formula C13H27NO and a molecular weight of 213.37 g/mol. Its IUPAC name is 4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol
PubChem CID165497433
Molecular FormulaC13H27NO
Molecular Weight213.37 g/mol
Exact Mass213.21
IUPAC Name4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol
SMILESCCC1CCC(O)CC1N(CC)C(C)C
InChIInChI=1S/C13H27NO/c1-5-11-7-8-12(15)9-13(11)14(6-2)10(3)4/h10-13,15H,5-9H2,1-4H3
InChIKeyQGJLEKYAHBYJTE-UHFFFAOYSA-N
XLogP2.66
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.37
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-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

3-[propan-2-yl(propyl)amino]-4-propylcyclohexan-1-ol
CID 165497914
3-[2-methylpropyl(propan-2-yl)amino]-4-propylcyclohexan-1-ol
CID 165497893
1-[ethyl-(2-ethylcyclobutyl)amino]ethanol
CID 89249159
3-[butyl(ethyl)amino]-4-ethylcyclohexan-1-ol
CID 165491780
2-N,4-diethyl-2-N-propan-2-ylcyclohexane-1,2-diamine
CID 43265755
4-methyl-3-[propan-2-yl(propyl)amino]cyclohexan-1-ol
CID 165491668
3-[butyl(methyl)amino]-4-ethylcyclohexan-1-ol
CID 165497432
2-[ethyl(propan-2-yl)amino]cyclohexan-1-ol
CID 60886338
2-[ethyl(propan-2-yl)amino]cyclododecan-1-ol
CID 63470374
ethane;N-ethyl-2-methyl-N-propan-2-ylcyclopropan-1-amine
CID 162751363
3-[ethyl(2-methylpropyl)amino]-4-propylcyclohexan-1-ol
CID 165497912
1-[ethyl-(2-ethylcyclohexyl)amino]ethanol
CID 89249438

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol?
The IUPAC name of 4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol (CID 165497433) is 4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol.
What is the SMILES notation for 4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol?
The canonical SMILES for 4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol is CCC1CCC(O)CC1N(CC)C(C)C.
What is the InChIKey of 4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol?
The InChIKey is QGJLEKYAHBYJTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-5-11-7-8-12(15)9-13(11)14(6-2)10(3)4/h10-13,15H,5-9H2,1-4H3.
What are the key properties of 4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol?
4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol has a molecular weight of 213.37 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-[ethyl(propan-2-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 165497433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).