(Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine

C9H18N2 — CID 142206942

IUPAC(Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine
SMILESC/C=C(\C=N\CC)CCNC
InChIInChI=1S/C9H18N2/c1-4-9(6-7-10-3)8-11-5-2/h4,8,10H,5-7H2,1-3H3/b9-4-,11-8+
InChIKeyLIPALGDONRZKAM-GVXASNAJSA-N
MW154.26 g/mol
LogP1.63
Rot. Bonds5

About (Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine

(Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine (PubChem CID 142206942) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is (Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine.

Molecular Properties

Compound Name(Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine
PubChem CID142206942
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name(Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine
SMILESC/C=C(\C=N\CC)CCNC
InChIInChI=1S/C9H18N2/c1-4-9(6-7-10-3)8-11-5-2/h4,8,10H,5-7H2,1-3H3/b9-4-,11-8+
InChIKeyLIPALGDONRZKAM-GVXASNAJSA-N
XLogP1.63
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1-(2,3-dihydropyridin-5-yl)-N-methylmethanamine
CID 89652924
N-methyl-2-(2H-pyrrol-4-yl)ethanamine
CID 90161354
N-methyl-3-(methyliminomethyl)hex-3-en-2-amine
CID 123203381
N,3-dimethyl-2-methylidene-5-methyliminopent-3-en-1-amine
CID 123218319
3-(2,3-dihydropyridin-5-yl)-N-methylpropan-1-amine
CID 123487173
N-methyl-5-methylidene-3-(methyliminomethyl)-4-propylhepta-3,6-dien-1-amine
CID 123736016
1-(2,3-dihydropyridin-4-yl)-N-methylmethanamine
CID 123777305
3-(2,3-dihydropyridin-4-yl)-N-methylpropan-1-amine
CID 123947708
(E)-N,2-dimethyl-3-(methyliminomethyl)pent-3-en-1-amine
CID 129144965
(Z)-N-ethyl-2-methanimidoylhex-2-en-1-amine
CID 139554966
(Z)-5-ethylimino-4-methylpent-3-en-2-amine
CID 142144613
2-(2,3-dihydropyridin-5-yl)-N,N-dimethylethanamine
CID 142206786

Frequently Asked Questions

What is the IUPAC name of (Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine?
The IUPAC name of (Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine (CID 142206942) is (Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine.
What is the SMILES notation for (Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine?
The canonical SMILES for (Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine is C/C=C(\C=N\CC)CCNC.
What is the InChIKey of (Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine?
The InChIKey is LIPALGDONRZKAM-GVXASNAJSA-N. The full InChI is InChI=1S/C9H18N2/c1-4-9(6-7-10-3)8-11-5-2/h4,8,10H,5-7H2,1-3H3/b9-4-,11-8+.
What are the key properties of (Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine?
(Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine has a molecular weight of 154.26 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(ethyliminomethyl)-N-methylpent-3-en-1-amine is sourced from PubChem (CID 142206942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).