(Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine

C13H21NO — CID 166149287

IUPAC(Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine
SMILESC=CC1=C(/C=C\CCC(C)NC)OCC1
InChIInChI=1S/C13H21NO/c1-4-12-9-10-15-13(12)8-6-5-7-11(2)14-3/h4,6,8,11,14H,1,5,7,9-10H2,2-3H3/b8-6-
InChIKeyBCAHBVWLLNNYFG-VURMDHGXSA-N
MW207.32 g/mol
LogP2.79
Rot. Bonds6

About (Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine

(Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine (PubChem CID 166149287) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is (Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine.

Molecular Properties

Compound Name(Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine
PubChem CID166149287
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name(Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine
SMILESC=CC1=C(/C=C\CCC(C)NC)OCC1
InChIInChI=1S/C13H21NO/c1-4-12-9-10-15-13(12)8-6-5-7-11(2)14-3/h4,6,8,11,14H,1,5,7,9-10H2,2-3H3/b8-6-
InChIKeyBCAHBVWLLNNYFG-VURMDHGXSA-N
XLogP2.79
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine?
The IUPAC name of (Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine (CID 166149287) is (Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine.
What is the SMILES notation for (Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine?
The canonical SMILES for (Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine is C=CC1=C(/C=C\CCC(C)NC)OCC1.
What is the InChIKey of (Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine?
The InChIKey is BCAHBVWLLNNYFG-VURMDHGXSA-N. The full InChI is InChI=1S/C13H21NO/c1-4-12-9-10-15-13(12)8-6-5-7-11(2)14-3/h4,6,8,11,14H,1,5,7,9-10H2,2-3H3/b8-6-.
What are the key properties of (Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine?
(Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine has a molecular weight of 207.32 g/mol, XLogP of 2.79, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-6-(4-ethenyl-2,3-dihydrofuran-5-yl)-N-methylhex-5-en-2-amine is sourced from PubChem (CID 166149287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).