3-methylcyclopropane-1,2-diamine

C4H10N2 — CID 15182444

IUPAC3-methylcyclopropane-1,2-diamine
SMILESCC1C(N)C1N
InChIInChI=1S/C4H10N2/c1-2-3(5)4(2)6/h2-4H,5-6H2,1H3
InChIKeyCNMAFRXOHFXMJN-UHFFFAOYSA-N
MW86.14 g/mol
LogP-0.71
Rot. Bonds

About 3-methylcyclopropane-1,2-diamine

3-methylcyclopropane-1,2-diamine (PubChem CID 15182444) has the molecular formula C4H10N2 and a molecular weight of 86.14 g/mol. Its IUPAC name is 3-methylcyclopropane-1,2-diamine.

Molecular Properties

Compound Name3-methylcyclopropane-1,2-diamine
PubChem CID15182444
Molecular FormulaC4H10N2
Molecular Weight86.14 g/mol
Exact Mass86.08
IUPAC Name3-methylcyclopropane-1,2-diamine
SMILESCC1C(N)C1N
InChIInChI=1S/C4H10N2/c1-2-3(5)4(2)6/h2-4H,5-6H2,1H3
InChIKeyCNMAFRXOHFXMJN-UHFFFAOYSA-N
XLogP-0.71
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.14
LogP ≤ 5-0.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methylcyclopropane-1,2-diamine?
The IUPAC name of 3-methylcyclopropane-1,2-diamine (CID 15182444) is 3-methylcyclopropane-1,2-diamine.
What is the SMILES notation for 3-methylcyclopropane-1,2-diamine?
The canonical SMILES for 3-methylcyclopropane-1,2-diamine is CC1C(N)C1N.
What is the InChIKey of 3-methylcyclopropane-1,2-diamine?
The InChIKey is CNMAFRXOHFXMJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2/c1-2-3(5)4(2)6/h2-4H,5-6H2,1H3.
What are the key properties of 3-methylcyclopropane-1,2-diamine?
3-methylcyclopropane-1,2-diamine has a molecular weight of 86.14 g/mol, XLogP of -0.71, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylcyclopropane-1,2-diamine is sourced from PubChem (CID 15182444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).