N,1-dimethylpyrrolidin-3-amine

C6H14N2 — CID 2758520

IUPACN,1-dimethylpyrrolidin-3-amine
SMILESCNC1CCN(C)C1
InChIInChI=1S/C6H14N2/c1-7-6-3-4-8(2)5-6/h6-7H,3-5H2,1-2H3
InChIKeyCZGIEJXGCLWRPY-UHFFFAOYSA-N
MW114.19 g/mol
LogP-0.09
Rot. Bonds1

About N,1-dimethylpyrrolidin-3-amine

N,1-dimethylpyrrolidin-3-amine (PubChem CID 2758520) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is N,1-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound NameN,1-dimethylpyrrolidin-3-amine
PubChem CID2758520
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC NameN,1-dimethylpyrrolidin-3-amine
SMILESCNC1CCN(C)C1
InChIInChI=1S/C6H14N2/c1-7-6-3-4-8(2)5-6/h6-7H,3-5H2,1-2H3
InChIKeyCZGIEJXGCLWRPY-UHFFFAOYSA-N
XLogP-0.09
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,1-dimethylpyrrolidin-3-amine?
The IUPAC name of N,1-dimethylpyrrolidin-3-amine (CID 2758520) is N,1-dimethylpyrrolidin-3-amine.
What is the SMILES notation for N,1-dimethylpyrrolidin-3-amine?
The canonical SMILES for N,1-dimethylpyrrolidin-3-amine is CNC1CCN(C)C1.
What is the InChIKey of N,1-dimethylpyrrolidin-3-amine?
The InChIKey is CZGIEJXGCLWRPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2/c1-7-6-3-4-8(2)5-6/h6-7H,3-5H2,1-2H3.
What are the key properties of N,1-dimethylpyrrolidin-3-amine?
N,1-dimethylpyrrolidin-3-amine has a molecular weight of 114.19 g/mol, XLogP of -0.09, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 2758520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).