1-(1-methylpyrrol-2-yl)cyclopropan-1-amine

C8H12N2 — CID 82593854

IUPAC1-(1-methylpyrrol-2-yl)cyclopropan-1-amine
SMILESCn1cccc1C1(N)CC1
InChIInChI=1S/C8H12N2/c1-10-6-2-3-7(10)8(9)4-5-8/h2-3,6H,4-5,9H2,1H3
InChIKeyFDGIMUVYBOVULO-UHFFFAOYSA-N
MW136.20 g/mol
LogP0.97
Rot. Bonds1

About 1-(1-methylpyrrol-2-yl)cyclopropan-1-amine

1-(1-methylpyrrol-2-yl)cyclopropan-1-amine (PubChem CID 82593854) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is 1-(1-methylpyrrol-2-yl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-(1-methylpyrrol-2-yl)cyclopropan-1-amine
PubChem CID82593854
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Name1-(1-methylpyrrol-2-yl)cyclopropan-1-amine
SMILESCn1cccc1C1(N)CC1
InChIInChI=1S/C8H12N2/c1-10-6-2-3-7(10)8(9)4-5-8/h2-3,6H,4-5,9H2,1H3
InChIKeyFDGIMUVYBOVULO-UHFFFAOYSA-N
XLogP0.97
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpyrrol-2-yl)cyclopropan-1-amine?
The IUPAC name of 1-(1-methylpyrrol-2-yl)cyclopropan-1-amine (CID 82593854) is 1-(1-methylpyrrol-2-yl)cyclopropan-1-amine.
What is the SMILES notation for 1-(1-methylpyrrol-2-yl)cyclopropan-1-amine?
The canonical SMILES for 1-(1-methylpyrrol-2-yl)cyclopropan-1-amine is Cn1cccc1C1(N)CC1.
What is the InChIKey of 1-(1-methylpyrrol-2-yl)cyclopropan-1-amine?
The InChIKey is FDGIMUVYBOVULO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2/c1-10-6-2-3-7(10)8(9)4-5-8/h2-3,6H,4-5,9H2,1H3.
What are the key properties of 1-(1-methylpyrrol-2-yl)cyclopropan-1-amine?
1-(1-methylpyrrol-2-yl)cyclopropan-1-amine has a molecular weight of 136.20 g/mol, XLogP of 0.97, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpyrrol-2-yl)cyclopropan-1-amine is sourced from PubChem (CID 82593854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).