N-methyl-1-pyrrolidin-2-ylethenamine

C7H14N2 — CID 142902514

IUPACN-methyl-1-pyrrolidin-2-ylethenamine
SMILESC=C(NC)C1CCCN1
InChIInChI=1S/C7H14N2/c1-6(8-2)7-4-3-5-9-7/h7-9H,1,3-5H2,2H3
InChIKeyAYWVYJKOUYCEBM-UHFFFAOYSA-N
MW126.20 g/mol
LogP0.47
Rot. Bonds2

About N-methyl-1-pyrrolidin-2-ylethenamine

N-methyl-1-pyrrolidin-2-ylethenamine (PubChem CID 142902514) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is N-methyl-1-pyrrolidin-2-ylethenamine.

Molecular Properties

Compound NameN-methyl-1-pyrrolidin-2-ylethenamine
PubChem CID142902514
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC NameN-methyl-1-pyrrolidin-2-ylethenamine
SMILESC=C(NC)C1CCCN1
InChIInChI=1S/C7H14N2/c1-6(8-2)7-4-3-5-9-7/h7-9H,1,3-5H2,2H3
InChIKeyAYWVYJKOUYCEBM-UHFFFAOYSA-N
XLogP0.47
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-pyrrolidin-2-ylethenamine?
The IUPAC name of N-methyl-1-pyrrolidin-2-ylethenamine (CID 142902514) is N-methyl-1-pyrrolidin-2-ylethenamine.
What is the SMILES notation for N-methyl-1-pyrrolidin-2-ylethenamine?
The canonical SMILES for N-methyl-1-pyrrolidin-2-ylethenamine is C=C(NC)C1CCCN1.
What is the InChIKey of N-methyl-1-pyrrolidin-2-ylethenamine?
The InChIKey is AYWVYJKOUYCEBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-6(8-2)7-4-3-5-9-7/h7-9H,1,3-5H2,2H3.
What are the key properties of N-methyl-1-pyrrolidin-2-ylethenamine?
N-methyl-1-pyrrolidin-2-ylethenamine has a molecular weight of 126.20 g/mol, XLogP of 0.47, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-pyrrolidin-2-ylethenamine is sourced from PubChem (CID 142902514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).