2-methyl-2,5-dihydro-1H-pyrrol-3-amine

C5H10N2 — CID 67882099

IUPAC2-methyl-2,5-dihydro-1H-pyrrol-3-amine
SMILESCC1NCC=C1N
InChIInChI=1S/C5H10N2/c1-4-5(6)2-3-7-4/h2,4,7H,3,6H2,1H3
InChIKeyPOGQBYFHNHOEFP-UHFFFAOYSA-N
MW98.15 g/mol
LogP-0.18
Rot. Bonds

About 2-methyl-2,5-dihydro-1H-pyrrol-3-amine

2-methyl-2,5-dihydro-1H-pyrrol-3-amine (PubChem CID 67882099) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is 2-methyl-2,5-dihydro-1H-pyrrol-3-amine.

Molecular Properties

Compound Name2-methyl-2,5-dihydro-1H-pyrrol-3-amine
PubChem CID67882099
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC Name2-methyl-2,5-dihydro-1H-pyrrol-3-amine
SMILESCC1NCC=C1N
InChIInChI=1S/C5H10N2/c1-4-5(6)2-3-7-4/h2,4,7H,3,6H2,1H3
InChIKeyPOGQBYFHNHOEFP-UHFFFAOYSA-N
XLogP-0.18
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2,5-dihydro-1H-pyrrol-3-amine?
The IUPAC name of 2-methyl-2,5-dihydro-1H-pyrrol-3-amine (CID 67882099) is 2-methyl-2,5-dihydro-1H-pyrrol-3-amine.
What is the SMILES notation for 2-methyl-2,5-dihydro-1H-pyrrol-3-amine?
The canonical SMILES for 2-methyl-2,5-dihydro-1H-pyrrol-3-amine is CC1NCC=C1N.
What is the InChIKey of 2-methyl-2,5-dihydro-1H-pyrrol-3-amine?
The InChIKey is POGQBYFHNHOEFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2/c1-4-5(6)2-3-7-4/h2,4,7H,3,6H2,1H3.
What are the key properties of 2-methyl-2,5-dihydro-1H-pyrrol-3-amine?
2-methyl-2,5-dihydro-1H-pyrrol-3-amine has a molecular weight of 98.15 g/mol, XLogP of -0.18, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2,5-dihydro-1H-pyrrol-3-amine is sourced from PubChem (CID 67882099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).