N-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine

C8H14N2 — CID 170123131

IUPACN-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine
SMILESC=CN(C)/N=C(C)\C=C/C
InChIInChI=1S/C8H14N2/c1-5-7-8(3)9-10(4)6-2/h5-7H,2H2,1,3-4H3/b7-5-,9-8-
InChIKeyHLEKCVZXXYEUFO-PJHABFGRSA-N
MW138.21 g/mol
LogP2.01
Rot. Bonds3

About N-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine

N-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine (PubChem CID 170123131) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is N-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine.

Molecular Properties

Compound NameN-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine
PubChem CID170123131
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC NameN-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine
SMILESC=CN(C)/N=C(C)\C=C/C
InChIInChI=1S/C8H14N2/c1-5-7-8(3)9-10(4)6-2/h5-7H,2H2,1,3-4H3/b7-5-,9-8-
InChIKeyHLEKCVZXXYEUFO-PJHABFGRSA-N
XLogP2.01
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(Z)-but-3-en-2-ylideneamino]-N-methylethenamine;ethane
CID 177175992
(Z)-N-[(E)-prop-1-enyl]pent-3-en-2-imine
CID 143911032
(NZ)-N-[(E)-pent-3-en-2-ylidene]hydroxylamine
CID 101070438
(Z)-N'-[(Z)-but-3-en-2-ylideneamino]-N,N,N'-trimethylethene-1,2-diamine
CID 170009667
(3E)-3-[ethenyl(methyl)hydrazinylidene]-N-methylbutan-1-amine
CID 142531060
(3E,5Z)-N-ethenyl-N,3-dimethylhepta-1,3,5-trien-4-amine
CID 142987567
N-(but-3-en-2-ylideneamino)-N-methylmethanamine
CID 535821
N-[(Z)-pent-3-en-2-ylidene]formamide
CID 146239104
(2E,4Z)-N-ethenyl-N,2,3-trimethylhexa-2,4-dien-1-amine
CID 134566444
(Z)-N-[(3Z)-2-methylpenta-1,3-dien-3-yl]pent-3-en-2-imine
CID 126661402
N-[(2Z,4Z)-3-methylhexa-2,4-dien-2-yl]methanimine
CID 139436221
N-[(1Z,3E)-2-methylpenta-1,3-dienyl]methanimine
CID 89119181

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine?
The IUPAC name of N-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine (CID 170123131) is N-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine.
What is the SMILES notation for N-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine?
The canonical SMILES for N-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine is C=CN(C)/N=C(C)\C=C/C.
What is the InChIKey of N-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine?
The InChIKey is HLEKCVZXXYEUFO-PJHABFGRSA-N. The full InChI is InChI=1S/C8H14N2/c1-5-7-8(3)9-10(4)6-2/h5-7H,2H2,1,3-4H3/b7-5-,9-8-.
What are the key properties of N-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine?
N-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine has a molecular weight of 138.21 g/mol, XLogP of 2.01, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]ethenamine is sourced from PubChem (CID 170123131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).