(Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine

C13H24N2 — CID 134406693

IUPAC(Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine
SMILESCC=C(C)/N=C(CC)/C(=C\CC)CNC
InChIInChI=1S/C13H24N2/c1-6-9-12(10-14-5)13(8-3)15-11(4)7-2/h7,9,14H,6,8,10H2,1-5H3/b11-7?,12-9-,15-13+
InChIKeyMQMRLVVTCSVXGI-SNSXCGGMSA-N
MW208.35 g/mol
LogP3.32
Rot. Bonds6

About (Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine

(Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine (PubChem CID 134406693) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is (Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine.

Molecular Properties

Compound Name(Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine
PubChem CID134406693
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name(Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine
SMILESCC=C(C)/N=C(CC)/C(=C\CC)CNC
InChIInChI=1S/C13H24N2/c1-6-9-12(10-14-5)13(8-3)15-11(4)7-2/h7,9,14H,6,8,10H2,1-5H3/b11-7?,12-9-,15-13+
InChIKeyMQMRLVVTCSVXGI-SNSXCGGMSA-N
XLogP3.32
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 53.32
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

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Hexahydroazonino[5,6-b]indole
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(Z)-N-pentyl-4-pentyliminopent-2-en-2-amine
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((1Z)-1-Methyl-2-(1-pyrrolin-2-yl)vinyl)(2-methylpropyl)amine
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N-methyl-6-methyliminocyclohexen-1-amine
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(E)-1-(3,4-dihydro-2H-pyrrol-5-yl)-N-ethylprop-1-en-2-amine
CID 68983220
[2-(4,5-Dihydro-3H-pyrrol-2-yl)-1-methyl-vinyl]-ethyl-amine
CID 68983223
[2-(4,5-Dihydro-3H-pyrrol-2-yl)-1-methyl-vinyl]-methyl-amine
CID 69247067
(3-butylidene-4H-pyridin-2-yl)methanamine
CID 70596861
3-methyl-5,6-dihydro-1H-cyclopenta[b]pyrazine
CID 89428743
(3Z)-N-ethyl-5-methyl-3-[1-(propan-2-ylideneamino)ethenyl]hexa-3,5-dien-1-amine
CID 91426030

Frequently Asked Questions

What is the IUPAC name of (Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine?
The IUPAC name of (Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine (CID 134406693) is (Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine.
What is the SMILES notation for (Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine?
The canonical SMILES for (Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine is CC=C(C)/N=C(CC)/C(=C\CC)CNC.
What is the InChIKey of (Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine?
The InChIKey is MQMRLVVTCSVXGI-SNSXCGGMSA-N. The full InChI is InChI=1S/C13H24N2/c1-6-9-12(10-14-5)13(8-3)15-11(4)7-2/h7,9,14H,6,8,10H2,1-5H3/b11-7?,12-9-,15-13+.
What are the key properties of (Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine?
(Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine has a molecular weight of 208.35 g/mol, XLogP of 3.32, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(N-but-2-en-2-yl-C-ethylcarbonimidoyl)-N-methylpent-2-en-1-amine is sourced from PubChem (CID 134406693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).