(1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine

C7H14N2 — CID 23053107

IUPAC(1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine
SMILESCN(C)/C=C1\CCNC1
InChIInChI=1S/C7H14N2/c1-9(2)6-7-3-4-8-5-7/h6,8H,3-5H2,1-2H3/b7-6+
InChIKeyPPTUSCSOAIUCMZ-VOTSOKGWSA-N
MW126.20 g/mol
LogP0.43
Rot. Bonds1

About (1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine

(1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine (PubChem CID 23053107) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is (1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine.

Molecular Properties

Compound Name(1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine
PubChem CID23053107
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name(1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine
SMILESCN(C)/C=C1\CCNC1
InChIInChI=1S/C7H14N2/c1-9(2)6-7-3-4-8-5-7/h6,8H,3-5H2,1-2H3/b7-6+
InChIKeyPPTUSCSOAIUCMZ-VOTSOKGWSA-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

Analyze (1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-Methylidenepyrrolidine
CID 10510810
4-methyl-2,3-dihydro-1H-pyrrole
CID 23323187
3-Vinylidenepyrrolidine
CID 123786754
CID 139244194
CID 139244194
3-Methylenepyrrolidine hydrochloride
CID 45158922
N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine
CID 54201813
3-Methyl-4-methylidenepyrrolidine
CID 55286286
1-Methanidyl-3-methylidenepyrrolidin-1-ium
CID 59347549
5-methyl-2,4,6,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrole
CID 66698029
5-ethyl-2,4,6,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrole
CID 67771186
(E)-pyrrolidin-3-ylidenemethanamine
CID 68260963
3-Methylidenepyrrolidin-1-ium
CID 86316372

Frequently Asked Questions

What is the IUPAC name of (1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine?
The IUPAC name of (1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine (CID 23053107) is (1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine.
What is the SMILES notation for (1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine?
The canonical SMILES for (1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine is CN(C)/C=C1\CCNC1.
What is the InChIKey of (1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine?
The InChIKey is PPTUSCSOAIUCMZ-VOTSOKGWSA-N. The full InChI is InChI=1S/C7H14N2/c1-9(2)6-7-3-4-8-5-7/h6,8H,3-5H2,1-2H3/b7-6+.
What are the key properties of (1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine?
(1E)-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 (1E)-N,N-dimethyl-1-pyrrolidin-3-ylidenemethanamine is sourced from PubChem (CID 23053107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).