N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine

C13H21NO — CID 103580766

IUPACN-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine
SMILESC1=CC(NC2CCOC2C2CC2)CCC1
InChIInChI=1S/C13H21NO/c1-2-4-11(5-3-1)14-12-8-9-15-13(12)10-6-7-10/h2,4,10-14H,1,3,5-9H2
InChIKeyJPAAVJSXIOWMAM-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.25
Rot. Bonds3

About N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine

N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine (PubChem CID 103580766) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine.

Molecular Properties

Compound NameN-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine
PubChem CID103580766
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC NameN-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine
SMILESC1=CC(NC2CCOC2C2CC2)CCC1
InChIInChI=1S/C13H21NO/c1-2-4-11(5-3-1)14-12-8-9-15-13(12)10-6-7-10/h2,4,10-14H,1,3,5-9H2
InChIKeyJPAAVJSXIOWMAM-UHFFFAOYSA-N
XLogP2.25
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-(cyclohex-2-en-1-ylamino)oxolan-3-ol
CID 130719542
N-(2,3-dimethylcyclopentyl)cyclohex-2-en-1-amine
CID 107907080
N-cyclohex-2-en-1-ylcyclooctanamine
CID 103830652
N-(2,2,3,3-tetramethylcyclopropyl)cyclohex-2-en-1-amine
CID 107907258
N-(cyclobutylmethyl)-2-cyclopropyloxolan-3-amine
CID 103580992
2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine
CID 102613100
N-(oxolan-2-ylmethyl)cyclohex-2-en-1-amine
CID 107906466
N-[1-(oxolan-2-yl)ethyl]cyclohex-2-en-1-amine
CID 104531391
N-(3-methylcyclopentyl)cyclohex-2-en-1-amine
CID 115893652
N-cyclohex-2-en-1-ylmorpholin-4-amine
CID 107907734
N-cyclohex-2-en-1-yl-3,4-dihydro-2H-chromen-4-amine
CID 103903513
N-(1,4-dioxan-2-ylmethyl)cyclohex-2-en-1-amine
CID 107906675

Frequently Asked Questions

What is the IUPAC name of N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine?
The IUPAC name of N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine (CID 103580766) is N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine.
What is the SMILES notation for N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine?
The canonical SMILES for N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine is C1=CC(NC2CCOC2C2CC2)CCC1.
What is the InChIKey of N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine?
The InChIKey is JPAAVJSXIOWMAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-2-4-11(5-3-1)14-12-8-9-15-13(12)10-6-7-10/h2,4,10-14H,1,3,5-9H2.
What are the key properties of N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine?
N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine has a molecular weight of 207.32 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine is sourced from PubChem (CID 103580766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).