4-methyl-1H-pyrrol-2-amine;pyridine

C10H13N3 — CID 174827367

IUPAC4-methyl-1H-pyrrol-2-amine;pyridine
SMILESCc1c[nH]c(N)c1.c1ccncc1
InChIInChI=1S/C5H8N2.C5H5N/c1-4-2-5(6)7-3-4;1-2-4-6-5-3-1/h2-3,7H,6H2,1H3;1-5H
InChIKeyYKSYVFSTBFAPOH-UHFFFAOYSA-N
MW175.23 g/mol
LogP1.99
Rot. Bonds

About 4-methyl-1H-pyrrol-2-amine;pyridine

4-methyl-1H-pyrrol-2-amine;pyridine (PubChem CID 174827367) has the molecular formula C10H13N3 and a molecular weight of 175.23 g/mol. Its IUPAC name is 4-methyl-1H-pyrrol-2-amine;pyridine.

Molecular Properties

Compound Name4-methyl-1H-pyrrol-2-amine;pyridine
PubChem CID174827367
Molecular FormulaC10H13N3
Molecular Weight175.23 g/mol
Exact Mass175.11
IUPAC Name4-methyl-1H-pyrrol-2-amine;pyridine
SMILESCc1c[nH]c(N)c1.c1ccncc1
InChIInChI=1S/C5H8N2.C5H5N/c1-4-2-5(6)7-3-4;1-2-4-6-5-3-1/h2-3,7H,6H2,1H3;1-5H
InChIKeyYKSYVFSTBFAPOH-UHFFFAOYSA-N
XLogP1.99
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-methyl-1H-pyrrol-2-amine;pyridine 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 4-methyl-1H-pyrrol-2-amine;pyridine?
The IUPAC name of 4-methyl-1H-pyrrol-2-amine;pyridine (CID 174827367) is 4-methyl-1H-pyrrol-2-amine;pyridine.
What is the SMILES notation for 4-methyl-1H-pyrrol-2-amine;pyridine?
The canonical SMILES for 4-methyl-1H-pyrrol-2-amine;pyridine is Cc1c[nH]c(N)c1.c1ccncc1.
What is the InChIKey of 4-methyl-1H-pyrrol-2-amine;pyridine?
The InChIKey is YKSYVFSTBFAPOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2.C5H5N/c1-4-2-5(6)7-3-4;1-2-4-6-5-3-1/h2-3,7H,6H2,1H3;1-5H.
What are the key properties of 4-methyl-1H-pyrrol-2-amine;pyridine?
4-methyl-1H-pyrrol-2-amine;pyridine has a molecular weight of 175.23 g/mol, XLogP of 1.99, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1H-pyrrol-2-amine;pyridine is sourced from PubChem (CID 174827367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).