(2-methylcyclopropyl)iminoazanium

C4H9N2+ — CID 163943473

IUPAC(2-methylcyclopropyl)iminoazanium
SMILESCC1CC1N=[NH2+]
InChIInChI=1S/C4H8N2/c1-3-2-4(3)6-5/h3-5H,2H2,1H3/p+1
InChIKeyRTBFPJHCLZRBKR-UHFFFAOYSA-O
MW85.13 g/mol
LogP-0.39
Rot. Bonds1

About (2-methylcyclopropyl)iminoazanium

(2-methylcyclopropyl)iminoazanium (PubChem CID 163943473) has the molecular formula C4H9N2+ and a molecular weight of 85.13 g/mol. Its IUPAC name is (2-methylcyclopropyl)iminoazanium.

Molecular Properties

Compound Name(2-methylcyclopropyl)iminoazanium
PubChem CID163943473
Molecular FormulaC4H9N2+
Molecular Weight85.13 g/mol
Exact Mass85.08
IUPAC Name(2-methylcyclopropyl)iminoazanium
SMILESCC1CC1N=[NH2+]
InChIInChI=1S/C4H8N2/c1-3-2-4(3)6-5/h3-5H,2H2,1H3/p+1
InChIKeyRTBFPJHCLZRBKR-UHFFFAOYSA-O
XLogP-0.39
TPSA37.95 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50085.13
LogP ≤ 5-0.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

N-[(1S)-2-methylcyclopropyl]ethenimine
CID 149214769
trans-(1S,2S)-1-(15N)azido-2-methylcyclopropane
CID 10749143
N'-(2-methylcyclopropyl)cyclohexanecarboximidamide
CID 63178369
(4S)-2,4-diisocyanato-1-methylcyclohexane
CID 126516901
3-methyl-4-nitrosocyclopentan-1-ol
CID 143364771
deuterium monohydride;1,2-dimethylcyclopropane
CID 159192336
1-amino-2-(2-methylcyclopropyl)guanidine
CID 64873830
N-(2,5-dimethylcyclohexyl)ethanimine
CID 138626194
cis-(1S,2R)-1-chloro-2-methylcyclopropane
CID 130909377
2-methyl-1-methylcyclopropane
CID 156629370
trans-(1R,2R)-2-methylcyclopropan-1-amine
CID 12953691
trans-(1S,4S)-1,2,3,4-tetramethylcyclopentane
CID 58443772

Frequently Asked Questions

What is the IUPAC name of (2-methylcyclopropyl)iminoazanium?
The IUPAC name of (2-methylcyclopropyl)iminoazanium (CID 163943473) is (2-methylcyclopropyl)iminoazanium.
What is the SMILES notation for (2-methylcyclopropyl)iminoazanium?
The canonical SMILES for (2-methylcyclopropyl)iminoazanium is CC1CC1N=[NH2+].
What is the InChIKey of (2-methylcyclopropyl)iminoazanium?
The InChIKey is RTBFPJHCLZRBKR-UHFFFAOYSA-O. The full InChI is InChI=1S/C4H8N2/c1-3-2-4(3)6-5/h3-5H,2H2,1H3/p+1.
What are the key properties of (2-methylcyclopropyl)iminoazanium?
(2-methylcyclopropyl)iminoazanium has a molecular weight of 85.13 g/mol, XLogP of -0.39, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylcyclopropyl)iminoazanium is sourced from PubChem (CID 163943473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).