(Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine

C11H22N2 — CID 177054126

IUPAC(Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine
SMILESC/C=C\C(CN(C)C(C)C)=N/CC
InChIInChI=1S/C11H22N2/c1-6-8-11(12-7-2)9-13(5)10(3)4/h6,8,10H,7,9H2,1-5H3/b8-6-,12-11+
InChIKeyYAKQSKJZUJGLLI-JKJKEFMNSA-N
MW182.31 g/mol
LogP2.36
Rot. Bonds5

About (Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine

(Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine (PubChem CID 177054126) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is (Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine.

Molecular Properties

Compound Name(Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine
PubChem CID177054126
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name(Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine
SMILESC/C=C\C(CN(C)C(C)C)=N/CC
InChIInChI=1S/C11H22N2/c1-6-8-11(12-7-2)9-13(5)10(3)4/h6,8,10H,7,9H2,1-5H3/b8-6-,12-11+
InChIKeyYAKQSKJZUJGLLI-JKJKEFMNSA-N
XLogP2.36
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 52.36
H-Bond Donors ≤ 50
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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CID 169616
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4-diazo-N,N-dipropylcyclohexa-2,5-dien-1-amine
CID 18779429
N,N-dibutyl-4-diazocyclohexa-2,5-dien-1-amine
CID 21470631
3,6-Bis-isopropylimino-cyclohexa-1,4-diene
CID 22617218
N-butyl-1-methyl-2,6-dihydropyridin-3-imine
CID 57045078
3-(3-ethylimino-2,6-dihydropyridin-1-yl)-N,N-dimethylpropan-1-amine
CID 57171418
N,N-dimethyl-1-(2H-pyrrol-5-yl)methanamine
CID 58270096
(4-Aminocyclohexa-2,5-dien-1-ylidene)-diethylazanium
CID 60040659
Cyclohexa-2,5-dien-1-ylidene(diethyl)azanium
CID 68384674
ethyl-[(5Z)-hepta-2,5-dien-4-ylidene]-methylazanium
CID 89961014
1,2-dimethyl-3,7-dihydro-2H-azepin-6-imine
CID 123316650

Frequently Asked Questions

What is the IUPAC name of (Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine?
The IUPAC name of (Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine (CID 177054126) is (Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine.
What is the SMILES notation for (Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine?
The canonical SMILES for (Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine is C/C=C\C(CN(C)C(C)C)=N/CC.
What is the InChIKey of (Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine?
The InChIKey is YAKQSKJZUJGLLI-JKJKEFMNSA-N. The full InChI is InChI=1S/C11H22N2/c1-6-8-11(12-7-2)9-13(5)10(3)4/h6,8,10H,7,9H2,1-5H3/b8-6-,12-11+.
What are the key properties of (Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine?
(Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine has a molecular weight of 182.31 g/mol, XLogP of 2.36, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-ethylimino-N-methyl-N-propan-2-ylpent-3-en-1-amine is sourced from PubChem (CID 177054126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).