4-cycloheptyloxolan-3-amine

C11H21NO — CID 84769198

IUPAC4-cycloheptyloxolan-3-amine
SMILESNC1COCC1C1CCCCCC1
InChIInChI=1S/C11H21NO/c12-11-8-13-7-10(11)9-5-3-1-2-4-6-9/h9-11H,1-8,12H2
InChIKeyZZMISZDCLAMLTK-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.93
Rot. Bonds1

About 4-cycloheptyloxolan-3-amine

4-cycloheptyloxolan-3-amine (PubChem CID 84769198) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 4-cycloheptyloxolan-3-amine.

Molecular Properties

Compound Name4-cycloheptyloxolan-3-amine
PubChem CID84769198
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name4-cycloheptyloxolan-3-amine
SMILESNC1COCC1C1CCCCCC1
InChIInChI=1S/C11H21NO/c12-11-8-13-7-10(11)9-5-3-1-2-4-6-9/h9-11H,1-8,12H2
InChIKeyZZMISZDCLAMLTK-UHFFFAOYSA-N
XLogP1.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

azane;4-cyclohexyloxan-3-amine;hydrochloride
CID 67358979
(4-cycloheptyloxolan-3-yl)methanamine
CID 84774594
(3R,4R)-oxolane-3,4-diamine;hydrochloride
CID 89488201
trans-(1R,2R)-2-cyclohexylcyclopropan-1-amine;hydrochloride
CID 134690804
2-cyclohexylcycloheptan-1-amine
CID 62603079
azane;4-cyclopropyloxan-3-amine;dihydrochloride
CID 67359568
5-cyclohexyl-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene
CID 59124996
3-cycloheptyl-2-methylcyclopentan-1-amine
CID 82924217
3-oxabicyclo[3.1.0]hexan-6-amine
CID 52988031
2-(oxan-4-yl)cyclobutan-1-amine
CID 81015020
4-(2-cycloheptylcyclobutyl)cyclononan-1-amine
CID 139360587
(1S,7S,8R)-bicyclo[5.2.0]nonan-8-amine;hydrochloride
CID 138987457

Frequently Asked Questions

What is the IUPAC name of 4-cycloheptyloxolan-3-amine?
The IUPAC name of 4-cycloheptyloxolan-3-amine (CID 84769198) is 4-cycloheptyloxolan-3-amine.
What is the SMILES notation for 4-cycloheptyloxolan-3-amine?
The canonical SMILES for 4-cycloheptyloxolan-3-amine is NC1COCC1C1CCCCCC1.
What is the InChIKey of 4-cycloheptyloxolan-3-amine?
The InChIKey is ZZMISZDCLAMLTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c12-11-8-13-7-10(11)9-5-3-1-2-4-6-9/h9-11H,1-8,12H2.
What are the key properties of 4-cycloheptyloxolan-3-amine?
4-cycloheptyloxolan-3-amine has a molecular weight of 183.29 g/mol, XLogP of 1.93, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cycloheptyloxolan-3-amine is sourced from PubChem (CID 84769198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).