hydron;2-methylpropan-1-amine

C4H12N+ — CID 3041751

IUPAChydron;2-methylpropan-1-amine
SMILESCC(C)CN.[H+]
InChIInChI=1S/C4H11N/c1-4(2)3-5/h4H,3,5H2,1-2H3/p+1
InChIKeyKDSNLYIMUZNERS-UHFFFAOYSA-O
MW74.15 g/mol
LogP0.71
Rot. Bonds1

About hydron;2-methylpropan-1-amine

hydron;2-methylpropan-1-amine (PubChem CID 3041751) has the molecular formula C4H12N+ and a molecular weight of 74.15 g/mol. Its IUPAC name is hydron;2-methylpropan-1-amine.

Molecular Properties

Compound Namehydron;2-methylpropan-1-amine
PubChem CID3041751
Molecular FormulaC4H12N+
Molecular Weight74.15 g/mol
Exact Mass74.10
IUPAC Namehydron;2-methylpropan-1-amine
SMILESCC(C)CN.[H+]
InChIInChI=1S/C4H11N/c1-4(2)3-5/h4H,3,5H2,1-2H3/p+1
InChIKeyKDSNLYIMUZNERS-UHFFFAOYSA-O
XLogP0.71
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50074.15
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze hydron;2-methylpropan-1-amine 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 hydron;2-methylpropan-1-amine?
The IUPAC name of hydron;2-methylpropan-1-amine (CID 3041751) is hydron;2-methylpropan-1-amine.
What is the SMILES notation for hydron;2-methylpropan-1-amine?
The canonical SMILES for hydron;2-methylpropan-1-amine is CC(C)CN.[H+].
What is the InChIKey of hydron;2-methylpropan-1-amine?
The InChIKey is KDSNLYIMUZNERS-UHFFFAOYSA-O. The full InChI is InChI=1S/C4H11N/c1-4(2)3-5/h4H,3,5H2,1-2H3/p+1.
What are the key properties of hydron;2-methylpropan-1-amine?
hydron;2-methylpropan-1-amine has a molecular weight of 74.15 g/mol, XLogP of 0.71, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;2-methylpropan-1-amine is sourced from PubChem (CID 3041751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).