1-[(2R)-oxolan-2-yl]hex-5-en-3-amine

C10H19NO — CID 167351391

IUPAC1-[(2R)-oxolan-2-yl]hex-5-en-3-amine
SMILESC=CCC(N)CC[C@@H]1CCCO1
InChIInChI=1S/C10H19NO/c1-2-4-9(11)6-7-10-5-3-8-12-10/h2,9-10H,1,3-8,11H2/t9?,10-/m0/s1
InChIKeyOQLRFWDUUVSPPL-AXDSSHIGSA-N
MW169.27 g/mol
LogP1.85
Rot. Bonds5

About 1-[(2R)-oxolan-2-yl]hex-5-en-3-amine

1-[(2R)-oxolan-2-yl]hex-5-en-3-amine (PubChem CID 167351391) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1-[(2R)-oxolan-2-yl]hex-5-en-3-amine.

Molecular Properties

Compound Name1-[(2R)-oxolan-2-yl]hex-5-en-3-amine
PubChem CID167351391
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-[(2R)-oxolan-2-yl]hex-5-en-3-amine
SMILESC=CCC(N)CC[C@@H]1CCCO1
InChIInChI=1S/C10H19NO/c1-2-4-9(11)6-7-10-5-3-8-12-10/h2,9-10H,1,3-8,11H2/t9?,10-/m0/s1
InChIKeyOQLRFWDUUVSPPL-AXDSSHIGSA-N
XLogP1.85
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.85
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

(2R,3R,6R)-2-methyl-6-prop-2-enyloxan-3-amine
CID 59552180
1-(Oxolan-2-yl)but-3-en-1-amine
CID 65331260
1-(Oxolan-2-yl)but-3-en-2-amine
CID 65575949
1-[(2S)-oxolan-2-yl]hex-5-en-3-amine
CID 167351449
1-(Oxolan-2-yl)pent-4-en-2-amine
CID 61380136
N-methyl-1-(oxolan-2-yl)pent-4-en-2-amine
CID 61380669
N-ethyl-1-(oxolan-2-yl)pent-4-en-2-amine
CID 61380670
1-(oxolan-2-yl)-N-propylpent-4-en-2-amine
CID 61380681
N-methyl-1-(oxolan-2-yl)hept-6-en-2-amine
CID 64297423
N-methyl-1-(oxolan-2-yl)hex-5-en-2-amine
CID 64297424
N-ethyl-1-(oxolan-2-yl)hept-6-en-2-amine
CID 64297425
N-ethyl-1-(oxolan-2-yl)hex-5-en-2-amine
CID 64297426

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-oxolan-2-yl]hex-5-en-3-amine?
The IUPAC name of 1-[(2R)-oxolan-2-yl]hex-5-en-3-amine (CID 167351391) is 1-[(2R)-oxolan-2-yl]hex-5-en-3-amine.
What is the SMILES notation for 1-[(2R)-oxolan-2-yl]hex-5-en-3-amine?
The canonical SMILES for 1-[(2R)-oxolan-2-yl]hex-5-en-3-amine is C=CCC(N)CC[C@@H]1CCCO1.
What is the InChIKey of 1-[(2R)-oxolan-2-yl]hex-5-en-3-amine?
The InChIKey is OQLRFWDUUVSPPL-AXDSSHIGSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-4-9(11)6-7-10-5-3-8-12-10/h2,9-10H,1,3-8,11H2/t9?,10-/m0/s1.
What are the key properties of 1-[(2R)-oxolan-2-yl]hex-5-en-3-amine?
1-[(2R)-oxolan-2-yl]hex-5-en-3-amine has a molecular weight of 169.27 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-oxolan-2-yl]hex-5-en-3-amine is sourced from PubChem (CID 167351391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).