N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine

C7H14N2 — CID 54201813

IUPACN,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine
SMILESCN(C)C=C1CCNC1
InChIInChI=1S/C7H14N2/c1-9(2)6-7-3-4-8-5-7/h6,8H,3-5H2,1-2H3
InChIKeyPPTUSCSOAIUCMZ-UHFFFAOYSA-N
MW126.20 g/mol
LogP0.43
Rot. Bonds1

About N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine

N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine (PubChem CID 54201813) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine
PubChem CID54201813
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC NameN,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine
SMILESCN(C)C=C1CCNC1
InChIInChI=1S/C7H14N2/c1-9(2)6-7-3-4-8-5-7/h6,8H,3-5H2,1-2H3
InChIKeyPPTUSCSOAIUCMZ-UHFFFAOYSA-N
XLogP0.43
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine?
The IUPAC name of N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine (CID 54201813) is N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine.
What is the SMILES notation for N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine?
The canonical SMILES for N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine is CN(C)C=C1CCNC1.
What is the InChIKey of N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine?
The InChIKey is PPTUSCSOAIUCMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-9(2)6-7-3-4-8-5-7/h6,8H,3-5H2,1-2H3.
What are the key properties of N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine?
N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine has a molecular weight of 126.20 g/mol, XLogP of 0.43, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine is sourced from PubChem (CID 54201813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).