N-methylpyrrolidin-1-amine

C5H12N2 — CID 19362293

IUPACN-methylpyrrolidin-1-amine
SMILESCNN1CCCC1
InChIInChI=1S/C5H12N2/c1-6-7-4-2-3-5-7/h6H,2-5H2,1H3
InChIKeyOHLXXFUDMGUKCG-UHFFFAOYSA-N
MW100.17 g/mol
LogP0.22
Rot. Bonds1

About N-methylpyrrolidin-1-amine

N-methylpyrrolidin-1-amine (PubChem CID 19362293) has the molecular formula C5H12N2 and a molecular weight of 100.17 g/mol. Its IUPAC name is N-methylpyrrolidin-1-amine.

Molecular Properties

Compound NameN-methylpyrrolidin-1-amine
PubChem CID19362293
Molecular FormulaC5H12N2
Molecular Weight100.17 g/mol
Exact Mass100.10
IUPAC NameN-methylpyrrolidin-1-amine
SMILESCNN1CCCC1
InChIInChI=1S/C5H12N2/c1-6-7-4-2-3-5-7/h6H,2-5H2,1H3
InChIKeyOHLXXFUDMGUKCG-UHFFFAOYSA-N
XLogP0.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.17
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methylpyrrolidin-1-amine?
The IUPAC name of N-methylpyrrolidin-1-amine (CID 19362293) is N-methylpyrrolidin-1-amine.
What is the SMILES notation for N-methylpyrrolidin-1-amine?
The canonical SMILES for N-methylpyrrolidin-1-amine is CNN1CCCC1.
What is the InChIKey of N-methylpyrrolidin-1-amine?
The InChIKey is OHLXXFUDMGUKCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2/c1-6-7-4-2-3-5-7/h6H,2-5H2,1H3.
What are the key properties of N-methylpyrrolidin-1-amine?
N-methylpyrrolidin-1-amine has a molecular weight of 100.17 g/mol, XLogP of 0.22, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylpyrrolidin-1-amine is sourced from PubChem (CID 19362293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).