4-propylcycloheptan-1-ol

C10H20O — CID 15687798

IUPAC4-propylcycloheptan-1-ol
SMILESCCCC1CCCC(O)CC1
InChIInChI=1S/C10H20O/c1-2-4-9-5-3-6-10(11)8-7-9/h9-11H,2-8H2,1H3
InChIKeyIPTXGPSZOLHCQY-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.73
Rot. Bonds2

About 4-propylcycloheptan-1-ol

4-propylcycloheptan-1-ol (PubChem CID 15687798) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 4-propylcycloheptan-1-ol.

Molecular Properties

Compound Name4-propylcycloheptan-1-ol
PubChem CID15687798
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name4-propylcycloheptan-1-ol
SMILESCCCC1CCCC(O)CC1
InChIInChI=1S/C10H20O/c1-2-4-9-5-3-6-10(11)8-7-9/h9-11H,2-8H2,1H3
InChIKeyIPTXGPSZOLHCQY-UHFFFAOYSA-N
XLogP2.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-methyl-4-propylcycloheptane
CID 90967653
1-(2-cyclohexylethyl)-4-[2-(4-propylcyclohexyl)ethyl]cyclohexane
CID 70430254
5-ethylcyclooctan-1-ol
CID 19931411
hydrazine;propylcyclobutane;hydrochloride
CID 18995287
propylcyclotetradecane
CID 90991550
3-[[(4-propylcycloheptyl)amino]methyl]cyclohexan-1-ol
CID 106124372
1-[2-(2-methylcyclopropyl)ethyl]-4-propylcycloheptane
CID 123786912
ethane;propane;propylcyclopropane
CID 145406182
1-methyl-5-propylcyclononane
CID 54361658
N-cyclobutyl-4-propylcycloheptan-1-amine
CID 65091278
1-butyl-4-propylcyclononane
CID 123467552
1,4-dipropylcyclohexane;pentane
CID 90867354

Frequently Asked Questions

What is the IUPAC name of 4-propylcycloheptan-1-ol?
The IUPAC name of 4-propylcycloheptan-1-ol (CID 15687798) is 4-propylcycloheptan-1-ol.
What is the SMILES notation for 4-propylcycloheptan-1-ol?
The canonical SMILES for 4-propylcycloheptan-1-ol is CCCC1CCCC(O)CC1.
What is the InChIKey of 4-propylcycloheptan-1-ol?
The InChIKey is IPTXGPSZOLHCQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-2-4-9-5-3-6-10(11)8-7-9/h9-11H,2-8H2,1H3.
What are the key properties of 4-propylcycloheptan-1-ol?
4-propylcycloheptan-1-ol has a molecular weight of 156.27 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propylcycloheptan-1-ol is sourced from PubChem (CID 15687798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).