2-methylbutane-2,3-diamine

C5H14N2 — CID 14251537

IUPAC2-methylbutane-2,3-diamine
SMILESCC(N)C(C)(C)N
InChIInChI=1S/C5H14N2/c1-4(6)5(2,3)7/h4H,6-7H2,1-3H3
InChIKeyMIKNSPXOIZYKIT-UHFFFAOYSA-N
MW102.18 g/mol
LogP0.07
Rot. Bonds1

About 2-methylbutane-2,3-diamine

2-methylbutane-2,3-diamine (PubChem CID 14251537) has the molecular formula C5H14N2 and a molecular weight of 102.18 g/mol. Its IUPAC name is 2-methylbutane-2,3-diamine.

Molecular Properties

Compound Name2-methylbutane-2,3-diamine
PubChem CID14251537
Molecular FormulaC5H14N2
Molecular Weight102.18 g/mol
Exact Mass102.12
IUPAC Name2-methylbutane-2,3-diamine
SMILESCC(N)C(C)(C)N
InChIInChI=1S/C5H14N2/c1-4(6)5(2,3)7/h4H,6-7H2,1-3H3
InChIKeyMIKNSPXOIZYKIT-UHFFFAOYSA-N
XLogP0.07
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.18
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-methylbutane-2,3-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methylbutane-2,3-diamine?
The IUPAC name of 2-methylbutane-2,3-diamine (CID 14251537) is 2-methylbutane-2,3-diamine.
What is the SMILES notation for 2-methylbutane-2,3-diamine?
The canonical SMILES for 2-methylbutane-2,3-diamine is CC(N)C(C)(C)N.
What is the InChIKey of 2-methylbutane-2,3-diamine?
The InChIKey is MIKNSPXOIZYKIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2/c1-4(6)5(2,3)7/h4H,6-7H2,1-3H3.
What are the key properties of 2-methylbutane-2,3-diamine?
2-methylbutane-2,3-diamine has a molecular weight of 102.18 g/mol, XLogP of 0.07, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylbutane-2,3-diamine is sourced from PubChem (CID 14251537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).