(Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine

C7H15N3 — CID 89186150

IUPAC(Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine
SMILESC/N=C/C=C(\N)C(C)NC
InChIInChI=1S/C7H15N3/c1-6(10-3)7(8)4-5-9-2/h4-6,10H,8H2,1-3H3/b7-4-,9-5+
InChIKeyXLFXDPFPOVZCLH-ICDOWURLSA-N
MW141.22 g/mol
LogP0.14
Rot. Bonds3

About (Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine

(Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine (PubChem CID 89186150) has the molecular formula C7H15N3 and a molecular weight of 141.22 g/mol. Its IUPAC name is (Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine.

Molecular Properties

Compound Name(Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine
PubChem CID89186150
Molecular FormulaC7H15N3
Molecular Weight141.22 g/mol
Exact Mass141.13
IUPAC Name(Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine
SMILESC/N=C/C=C(\N)C(C)NC
InChIInChI=1S/C7H15N3/c1-6(10-3)7(8)4-5-9-2/h4-6,10H,8H2,1-3H3/b7-4-,9-5+
InChIKeyXLFXDPFPOVZCLH-ICDOWURLSA-N
XLogP0.14
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.22
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine?
The IUPAC name of (Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine (CID 89186150) is (Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine.
What is the SMILES notation for (Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine?
The canonical SMILES for (Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine is C/N=C/C=C(\N)C(C)NC.
What is the InChIKey of (Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine?
The InChIKey is XLFXDPFPOVZCLH-ICDOWURLSA-N. The full InChI is InChI=1S/C7H15N3/c1-6(10-3)7(8)4-5-9-2/h4-6,10H,8H2,1-3H3/b7-4-,9-5+.
What are the key properties of (Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine?
(Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine has a molecular weight of 141.22 g/mol, XLogP of 0.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-N-methyl-5-methyliminopent-3-ene-2,3-diamine is sourced from PubChem (CID 89186150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).