(Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine

C6H12N2 — CID 166891358

IUPAC(Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine
SMILESCC1(/C(N)=C/N)CC1
InChIInChI=1S/C6H12N2/c1-6(2-3-6)5(8)4-7/h4H,2-3,7-8H2,1H3/b5-4-
InChIKeyDQYBZLCUHBQYCB-PLNGDYQASA-N
MW112.18 g/mol
LogP0.55
Rot. Bonds1

About (Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine

(Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine (PubChem CID 166891358) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is (Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine.

Molecular Properties

Compound Name(Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine
PubChem CID166891358
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name(Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine
SMILESCC1(/C(N)=C/N)CC1
InChIInChI=1S/C6H12N2/c1-6(2-3-6)5(8)4-7/h4H,2-3,7-8H2,1H3/b5-4-
InChIKeyDQYBZLCUHBQYCB-PLNGDYQASA-N
XLogP0.55
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine?
The IUPAC name of (Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine (CID 166891358) is (Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine.
What is the SMILES notation for (Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine?
The canonical SMILES for (Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine is CC1(/C(N)=C/N)CC1.
What is the InChIKey of (Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine?
The InChIKey is DQYBZLCUHBQYCB-PLNGDYQASA-N. The full InChI is InChI=1S/C6H12N2/c1-6(2-3-6)5(8)4-7/h4H,2-3,7-8H2,1H3/b5-4-.
What are the key properties of (Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine?
(Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine has a molecular weight of 112.18 g/mol, XLogP of 0.55, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-(1-methylcyclopropyl)ethene-1,2-diamine is sourced from PubChem (CID 166891358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).