(Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine

C7H9N3 — CID 147864393

IUPAC(Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine
SMILESC=C1C=CN=C1N/C=C\N
InChIInChI=1S/C7H9N3/c1-6-2-4-9-7(6)10-5-3-8/h2-5H,1,8H2,(H,9,10)/b5-3-
InChIKeyHXISAHLEDGMDAR-HYXAFXHYSA-N
MW135.17 g/mol
LogP0.49
Rot. Bonds1

About (Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine

(Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine (PubChem CID 147864393) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is (Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine.

Molecular Properties

Compound Name(Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine
PubChem CID147864393
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name(Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine
SMILESC=C1C=CN=C1N/C=C\N
InChIInChI=1S/C7H9N3/c1-6-2-4-9-7(6)10-5-3-8/h2-5H,1,8H2,(H,9,10)/b5-3-
InChIKeyHXISAHLEDGMDAR-HYXAFXHYSA-N
XLogP0.49
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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1,4-Dihydropyrrolo[2,3-b]pyridin-4-ide;tungsten
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(3Z)-4-(aminomethyl)-N-ethenyl-3-ethylidenepyrrol-2-amine
CID 89289290
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(4Z)-N-ethenyl-4-ethylidene-2,3-dihydropyrrol-5-amine
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N-ethenyl-3-propan-2-ylidenepyrrol-2-amine
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3-methylidene-N-(2-methyliminoethenyl)pyrrol-2-amine
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CID 136437877

Frequently Asked Questions

What is the IUPAC name of (Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine?
The IUPAC name of (Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine (CID 147864393) is (Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine.
What is the SMILES notation for (Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine?
The canonical SMILES for (Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine is C=C1C=CN=C1N/C=C\N.
What is the InChIKey of (Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine?
The InChIKey is HXISAHLEDGMDAR-HYXAFXHYSA-N. The full InChI is InChI=1S/C7H9N3/c1-6-2-4-9-7(6)10-5-3-8/h2-5H,1,8H2,(H,9,10)/b5-3-.
What are the key properties of (Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine?
(Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine has a molecular weight of 135.17 g/mol, XLogP of 0.49, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N'-(3-methylidenepyrrol-2-yl)ethene-1,2-diamine is sourced from PubChem (CID 147864393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).