(Z)-2-ethoxy-N-methylbut-2-en-1-amine

C7H15NO — CID 143377801

IUPAC(Z)-2-ethoxy-N-methylbut-2-en-1-amine
SMILESC/C=C(/CNC)OCC
InChIInChI=1S/C7H15NO/c1-4-7(6-8-3)9-5-2/h4,8H,5-6H2,1-3H3/b7-4-
InChIKeyGFIMUKAENLKXBW-DAXSKMNVSA-N
MW129.20 g/mol
LogP1.15
Rot. Bonds4

About (Z)-2-ethoxy-N-methylbut-2-en-1-amine

(Z)-2-ethoxy-N-methylbut-2-en-1-amine (PubChem CID 143377801) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is (Z)-2-ethoxy-N-methylbut-2-en-1-amine.

Molecular Properties

Compound Name(Z)-2-ethoxy-N-methylbut-2-en-1-amine
PubChem CID143377801
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name(Z)-2-ethoxy-N-methylbut-2-en-1-amine
SMILESC/C=C(/CNC)OCC
InChIInChI=1S/C7H15NO/c1-4-7(6-8-3)9-5-2/h4,8H,5-6H2,1-3H3/b7-4-
InChIKeyGFIMUKAENLKXBW-DAXSKMNVSA-N
XLogP1.15
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

(Z)-3-ethoxypent-3-en-1-amine
CID 177319972
(Z)-2-ethoxy-1-ethylsulfanylbut-2-ene
CID 23261322
3,4-diethoxyhexa-2,4-diene
CID 141009141
ethyl 2-[[(Z)-2-amino-3-(methylamino)prop-1-enyl]amino]acetate
CID 138720480
(E)-1-ethoxy-N,N'-dimethylethene-1,2-diamine
CID 167034906
(2Z)-6-ethoxyocta-2,5-diene
CID 143636508
ethyl 4-[2-(methylamino)acetyl]piperazine-1-carboxylate
CID 54773405
2-ethoxybut-2-ene;silane
CID 174428196
ethyl 2-oxoacetate;N-methylmethanamine
CID 162730007
(Z)-2-ethylsulfanyl-N-methylbut-2-en-1-amine
CID 143258861
ethyl 3-[3-(methylamino)prop-1-en-2-ylamino]-3-oxopropanoate
CID 155440095
diethyl N,N'-dihydroxypropanediimidate
CID 174681376

Frequently Asked Questions

What is the IUPAC name of (Z)-2-ethoxy-N-methylbut-2-en-1-amine?
The IUPAC name of (Z)-2-ethoxy-N-methylbut-2-en-1-amine (CID 143377801) is (Z)-2-ethoxy-N-methylbut-2-en-1-amine.
What is the SMILES notation for (Z)-2-ethoxy-N-methylbut-2-en-1-amine?
The canonical SMILES for (Z)-2-ethoxy-N-methylbut-2-en-1-amine is C/C=C(/CNC)OCC.
What is the InChIKey of (Z)-2-ethoxy-N-methylbut-2-en-1-amine?
The InChIKey is GFIMUKAENLKXBW-DAXSKMNVSA-N. The full InChI is InChI=1S/C7H15NO/c1-4-7(6-8-3)9-5-2/h4,8H,5-6H2,1-3H3/b7-4-.
What are the key properties of (Z)-2-ethoxy-N-methylbut-2-en-1-amine?
(Z)-2-ethoxy-N-methylbut-2-en-1-amine has a molecular weight of 129.20 g/mol, XLogP of 1.15, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-ethoxy-N-methylbut-2-en-1-amine is sourced from PubChem (CID 143377801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).