(Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine

C7H15N3 — CID 148562153

IUPAC(Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine
SMILESC/N=C(C)/C(=C\N)CNC
InChIInChI=1S/C7H15N3/c1-6(10-3)7(4-8)5-9-2/h4,9H,5,8H2,1-3H3/b7-4-,10-6+
InChIKeyMVEZAHMNLOLMBV-HLWKLQMVSA-N
MW141.22 g/mol
LogP0.14
Rot. Bonds3

About (Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine

(Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine (PubChem CID 148562153) has the molecular formula C7H15N3 and a molecular weight of 141.22 g/mol. Its IUPAC name is (Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine.

Molecular Properties

Compound Name(Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine
PubChem CID148562153
Molecular FormulaC7H15N3
Molecular Weight141.22 g/mol
Exact Mass141.13
IUPAC Name(Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine
SMILESC/N=C(C)/C(=C\N)CNC
InChIInChI=1S/C7H15N3/c1-6(10-3)7(4-8)5-9-2/h4,9H,5,8H2,1-3H3/b7-4-,10-6+
InChIKeyMVEZAHMNLOLMBV-HLWKLQMVSA-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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4-methyl-5-methylidene-2,6-dihydro-1H-pyrimidine
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3-imino-N-methyl-2-methylidenebutan-1-amine
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(Z)-N,3-dimethyl-2-[C-methyl-N-[(Z)-2-methyl-3-(methylamino)prop-2-enyl]carbonimidoyl]pent-2-en-1-amine
CID 126661608
3-Prop-1-en-2-yl-1,2-dihydropyrazin-6-amine
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N-ethenyl-4-methylidenepyrrolidin-3-imine
CID 130347355
(Z)-(4-methyliminopyrrolidin-3-ylidene)methanamine
CID 135275464
(E)-3-(but-3-en-2-ylideneamino)-N,2-dimethylprop-2-en-1-amine;ethane
CID 142057454
2-Methyl-3-methyliminobut-1-en-1-amine
CID 143096692
(Z)-(4-iminopyrrolidin-3-ylidene)methanamine
CID 153289373
(4-Amino-3-methylbut-3-en-2-ylidene)-methylazanium
CID 153643636

Frequently Asked Questions

What is the IUPAC name of (Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine?
The IUPAC name of (Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine (CID 148562153) is (Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine.
What is the SMILES notation for (Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine?
The canonical SMILES for (Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine is C/N=C(C)/C(=C\N)CNC.
What is the InChIKey of (Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine?
The InChIKey is MVEZAHMNLOLMBV-HLWKLQMVSA-N. The full InChI is InChI=1S/C7H15N3/c1-6(10-3)7(4-8)5-9-2/h4,9H,5,8H2,1-3H3/b7-4-,10-6+.
What are the key properties of (Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine?
(Z)-2-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-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-(C,N-dimethylcarbonimidoyl)-N'-methylprop-1-ene-1,3-diamine is sourced from PubChem (CID 148562153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).