1-(oxolan-3-yl)non-8-en-2-amine

C13H25NO — CID 107009635

IUPAC1-(oxolan-3-yl)non-8-en-2-amine
SMILESC=CCCCCCC(N)CC1CCOC1
InChIInChI=1S/C13H25NO/c1-2-3-4-5-6-7-13(14)10-12-8-9-15-11-12/h2,12-13H,1,3-11,14H2
InChIKeyNAQPVWSRDAINJO-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.88
Rot. Bonds8

About 1-(oxolan-3-yl)non-8-en-2-amine

1-(oxolan-3-yl)non-8-en-2-amine (PubChem CID 107009635) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 1-(oxolan-3-yl)non-8-en-2-amine.

Molecular Properties

Compound Name1-(oxolan-3-yl)non-8-en-2-amine
PubChem CID107009635
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name1-(oxolan-3-yl)non-8-en-2-amine
SMILESC=CCCCCCC(N)CC1CCOC1
InChIInChI=1S/C13H25NO/c1-2-3-4-5-6-7-13(14)10-12-8-9-15-11-12/h2,12-13H,1,3-11,14H2
InChIKeyNAQPVWSRDAINJO-UHFFFAOYSA-N
XLogP2.88
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6,6,6-trifluoro-1-(oxolan-3-yl)hexan-2-amine
CID 103986760
5-methyl-1-(oxolan-3-yl)hexan-2-amine
CID 103986842
5-ethylsulfonyl-1-(oxolan-3-yl)pentan-2-amine
CID 103986638
5,5,5-trifluoro-1-(oxolan-3-yl)pentan-2-amine
CID 103986661
1-(oxan-4-yl)heptan-2-amine
CID 115846998
4-amino-5-(oxolan-3-yl)pentanoic acid
CID 62961692
4-(oxolan-2-yl)-1-(oxolan-3-yl)butan-2-amine
CID 103986756
3-prop-2-enyloxolane
CID 22481091
octadec-17-ene-1,1-diamine
CID 87111501
1,2-bis(oxolan-3-yl)ethanamine
CID 103986754
1-(oxolan-3-yl)butane-2,3-diamine
CID 126685843
1-(oxolan-3-yl)oct-7-en-1-one
CID 107008260

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-3-yl)non-8-en-2-amine?
The IUPAC name of 1-(oxolan-3-yl)non-8-en-2-amine (CID 107009635) is 1-(oxolan-3-yl)non-8-en-2-amine.
What is the SMILES notation for 1-(oxolan-3-yl)non-8-en-2-amine?
The canonical SMILES for 1-(oxolan-3-yl)non-8-en-2-amine is C=CCCCCCC(N)CC1CCOC1.
What is the InChIKey of 1-(oxolan-3-yl)non-8-en-2-amine?
The InChIKey is NAQPVWSRDAINJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-2-3-4-5-6-7-13(14)10-12-8-9-15-11-12/h2,12-13H,1,3-11,14H2.
What are the key properties of 1-(oxolan-3-yl)non-8-en-2-amine?
1-(oxolan-3-yl)non-8-en-2-amine has a molecular weight of 211.35 g/mol, XLogP of 2.88, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-3-yl)non-8-en-2-amine is sourced from PubChem (CID 107009635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).