4-methoxy-3-propylcyclohexan-1-ol

C10H20O2 — CID 142147619

IUPAC4-methoxy-3-propylcyclohexan-1-ol
SMILESCCCC1CC(O)CCC1OC
InChIInChI=1S/C10H20O2/c1-3-4-8-7-9(11)5-6-10(8)12-2/h8-11H,3-7H2,1-2H3
InChIKeyQREOBRCKORNWRN-UHFFFAOYSA-N
MW172.27 g/mol
LogP1.96
Rot. Bonds3

About 4-methoxy-3-propylcyclohexan-1-ol

4-methoxy-3-propylcyclohexan-1-ol (PubChem CID 142147619) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 4-methoxy-3-propylcyclohexan-1-ol.

Molecular Properties

Compound Name4-methoxy-3-propylcyclohexan-1-ol
PubChem CID142147619
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name4-methoxy-3-propylcyclohexan-1-ol
SMILESCCCC1CC(O)CCC1OC
InChIInChI=1S/C10H20O2/c1-3-4-8-7-9(11)5-6-10(8)12-2/h8-11H,3-7H2,1-2H3
InChIKeyQREOBRCKORNWRN-UHFFFAOYSA-N
XLogP1.96
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-propylcyclohexane-1,4-diol
CID 89257932
3-(2-aminopropyl)-4-methoxycyclohexan-1-ol
CID 154699686
3,4-dibutylcyclohexan-1-ol
CID 71347162
3-methoxy-4-methylcyclohexan-1-ol
CID 89006966
4-[3-(3,4-dimethoxycyclohexyl)propyl]cyclohexan-1-ol
CID 156542299
[(1R,2R)-2-methoxycyclobutyl]methanethiol
CID 155820893
3-[2-methylpropyl(propan-2-yl)amino]-4-propylcyclohexan-1-ol
CID 165497893
3-(azocan-1-yl)-4-propylcyclohexan-1-ol
CID 165499364
trans-(1S,3S)-3-methoxycyclopentan-1-ol
CID 97049174
3-[propan-2-yl(propyl)amino]-4-propylcyclohexan-1-ol
CID 165497914
1-(5-hydroxy-2-propylcyclohexyl)-3-methylimidazolidine-2,4-dione
CID 165498798
CID 89088507
CID 89088507

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-propylcyclohexan-1-ol?
The IUPAC name of 4-methoxy-3-propylcyclohexan-1-ol (CID 142147619) is 4-methoxy-3-propylcyclohexan-1-ol.
What is the SMILES notation for 4-methoxy-3-propylcyclohexan-1-ol?
The canonical SMILES for 4-methoxy-3-propylcyclohexan-1-ol is CCCC1CC(O)CCC1OC.
What is the InChIKey of 4-methoxy-3-propylcyclohexan-1-ol?
The InChIKey is QREOBRCKORNWRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-3-4-8-7-9(11)5-6-10(8)12-2/h8-11H,3-7H2,1-2H3.
What are the key properties of 4-methoxy-3-propylcyclohexan-1-ol?
4-methoxy-3-propylcyclohexan-1-ol has a molecular weight of 172.27 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-propylcyclohexan-1-ol is sourced from PubChem (CID 142147619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).