3-methylpyrrolidin-3-amine

C5H12N2 — CID 15595853

IUPAC3-methylpyrrolidin-3-amine
SMILESCC1(N)CCNC1
InChIInChI=1S/C5H12N2/c1-5(6)2-3-7-4-5/h7H,2-4,6H2,1H3
InChIKeyWGOWOSXVPSBDEY-UHFFFAOYSA-N
MW100.16 g/mol
LogP-0.30
Rot. Bonds

About 3-methylpyrrolidin-3-amine

3-methylpyrrolidin-3-amine (PubChem CID 15595853) has the molecular formula C5H12N2 and a molecular weight of 100.16 g/mol. Its IUPAC name is 3-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name3-methylpyrrolidin-3-amine
PubChem CID15595853
Molecular FormulaC5H12N2
Molecular Weight100.16 g/mol
Exact Mass100.10
IUPAC Name3-methylpyrrolidin-3-amine
SMILESCC1(N)CCNC1
InChIInChI=1S/C5H12N2/c1-5(6)2-3-7-4-5/h7H,2-4,6H2,1H3
InChIKeyWGOWOSXVPSBDEY-UHFFFAOYSA-N
XLogP-0.30
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.16
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methylpyrrolidin-3-amine?
The IUPAC name of 3-methylpyrrolidin-3-amine (CID 15595853) is 3-methylpyrrolidin-3-amine.
What is the SMILES notation for 3-methylpyrrolidin-3-amine?
The canonical SMILES for 3-methylpyrrolidin-3-amine is CC1(N)CCNC1.
What is the InChIKey of 3-methylpyrrolidin-3-amine?
The InChIKey is WGOWOSXVPSBDEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2/c1-5(6)2-3-7-4-5/h7H,2-4,6H2,1H3.
What are the key properties of 3-methylpyrrolidin-3-amine?
3-methylpyrrolidin-3-amine has a molecular weight of 100.16 g/mol, XLogP of -0.30, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylpyrrolidin-3-amine is sourced from PubChem (CID 15595853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).