5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine

C10H15NO — CID 142279302

IUPAC5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine
SMILESC=CC1=C(C(=C)C)C(N)COC1
InChIInChI=1S/C10H15NO/c1-4-8-5-12-6-9(11)10(8)7(2)3/h4,9H,1-2,5-6,11H2,3H3
InChIKeyPBDPSYDVGMVIFL-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.40
Rot. Bonds2

About 5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine

5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine (PubChem CID 142279302) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine.

Molecular Properties

Compound Name5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine
PubChem CID142279302
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine
SMILESC=CC1=C(C(=C)C)C(N)COC1
InChIInChI=1S/C10H15NO/c1-4-8-5-12-6-9(11)10(8)7(2)3/h4,9H,1-2,5-6,11H2,3H3
InChIKeyPBDPSYDVGMVIFL-UHFFFAOYSA-N
XLogP1.40
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R,5Z)-5-[(2E)-2,4-difluoropenta-2,4-dienylidene]oxan-3-amine
CID 117962776
4-Fluoro-6-pentan-2-yloxycyclohexa-2,4-dien-1-amine
CID 148191835
1-(1,6-Dimethylphenoxy)-2-aminopropane
CID 129724544
4-Methyl-5-amino-5,6-dihydropyran
CID 129811699
6-Methoxy-4,5,6-trimethylcyclohexa-2,4-dien-1-amine
CID 22065600
1-Cyclohexa-1,5-dien-1-yl-2-methoxyethanamine
CID 67160130
1-(5-Cyclohexa-1,3-dien-1-yl-1,4-dioxin-2-yl)ethanamine
CID 67493337
6-Ethoxy-6-ethylcyclohexa-2,4-dien-1-amine
CID 67857196
1-(6-Cyclohexa-1,3-dien-1-yl-1,4-dioxin-2-yl)ethanamine
CID 68764051
6-Ethyl-6-methoxycyclohexa-2,4-dien-1-amine
CID 69324874
1-(1-Ethoxycyclohexa-2,4-dien-1-yl)ethanamine
CID 70059595
3-(Methoxymethyl)-2-methylcyclohexa-2,4-dien-1-amine
CID 88985054

Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine?
The IUPAC name of 5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine (CID 142279302) is 5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine.
What is the SMILES notation for 5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine?
The canonical SMILES for 5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine is C=CC1=C(C(=C)C)C(N)COC1.
What is the InChIKey of 5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine?
The InChIKey is PBDPSYDVGMVIFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-4-8-5-12-6-9(11)10(8)7(2)3/h4,9H,1-2,5-6,11H2,3H3.
What are the key properties of 5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine?
5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine has a molecular weight of 165.24 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-4-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-amine is sourced from PubChem (CID 142279302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).