3-methylidenepyrrol-2-amine

C5H6N2 — CID 143334028

IUPAC3-methylidenepyrrol-2-amine
SMILESC=C1C=CN=C1N
InChIInChI=1S/C5H6N2/c1-4-2-3-7-5(4)6/h2-3H,1H2,(H2,6,7)
InChIKeyHKIFBRHZLKZYJS-UHFFFAOYSA-N
MW94.12 g/mol
LogP0.43
Rot. Bonds

About 3-methylidenepyrrol-2-amine

3-methylidenepyrrol-2-amine (PubChem CID 143334028) has the molecular formula C5H6N2 and a molecular weight of 94.12 g/mol. Its IUPAC name is 3-methylidenepyrrol-2-amine.

Molecular Properties

Compound Name3-methylidenepyrrol-2-amine
PubChem CID143334028
Molecular FormulaC5H6N2
Molecular Weight94.12 g/mol
Exact Mass94.05
IUPAC Name3-methylidenepyrrol-2-amine
SMILESC=C1C=CN=C1N
InChIInChI=1S/C5H6N2/c1-4-2-3-7-5(4)6/h2-3H,1H2,(H2,6,7)
InChIKeyHKIFBRHZLKZYJS-UHFFFAOYSA-N
XLogP0.43
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50094.12
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methylidenepyrrol-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

3-Methyl-1-azacyclohepta-1,3,4,6-tetraen-2-amine
CID 88233778
(3Z)-3-[(Z)-2-methylbut-2-enylidene]pyrrol-2-amine
CID 118474874
N'-ethenyl-2-methylidenebut-3-enimidamide
CID 138636758
3-Propan-2-ylidenepyrrol-2-amine
CID 139366195
3-Methylidenepyrrol-2-amine;molecular hydrogen
CID 143334027
2-methyl-N'-[(Z)-prop-1-enyl]prop-2-enimidamide
CID 143600490
(3E)-3-(bromomethylidene)pyrrol-2-amine
CID 143647057
(3Z)-3-but-3-enylidenepyrrol-2-amine
CID 143713204
N-(3-methylidenepyrrol-2-yl)hydroxylamine
CID 144263971
N-ethyl-3-methylidene-1H-pyrrol-2-imine
CID 144420368
(2E)-2-[(methylideneamino)methylidene]but-3-enimidamide
CID 144500508
N-methyl-3-methylidene-1H-pyrrol-2-imine
CID 144545721

Frequently Asked Questions

What is the IUPAC name of 3-methylidenepyrrol-2-amine?
The IUPAC name of 3-methylidenepyrrol-2-amine (CID 143334028) is 3-methylidenepyrrol-2-amine.
What is the SMILES notation for 3-methylidenepyrrol-2-amine?
The canonical SMILES for 3-methylidenepyrrol-2-amine is C=C1C=CN=C1N.
What is the InChIKey of 3-methylidenepyrrol-2-amine?
The InChIKey is HKIFBRHZLKZYJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2/c1-4-2-3-7-5(4)6/h2-3H,1H2,(H2,6,7).
What are the key properties of 3-methylidenepyrrol-2-amine?
3-methylidenepyrrol-2-amine has a molecular weight of 94.12 g/mol, XLogP of 0.43, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidenepyrrol-2-amine is sourced from PubChem (CID 143334028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).