N,N-dimethyl-1-pyrrol-2-ylidenemethanamine

C7H10N2 — CID 54170759

IUPACN,N-dimethyl-1-pyrrol-2-ylidenemethanamine
SMILESCN(C)C=C1C=CC=N1
InChIInChI=1S/C7H10N2/c1-9(2)6-7-4-3-5-8-7/h3-6H,1-2H3
InChIKeyOUVWRMOKHVEGJB-UHFFFAOYSA-N
MW122.17 g/mol
LogP1.03
Rot. Bonds1

About N,N-dimethyl-1-pyrrol-2-ylidenemethanamine

N,N-dimethyl-1-pyrrol-2-ylidenemethanamine (PubChem CID 54170759) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is N,N-dimethyl-1-pyrrol-2-ylidenemethanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-pyrrol-2-ylidenemethanamine
PubChem CID54170759
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC NameN,N-dimethyl-1-pyrrol-2-ylidenemethanamine
SMILESCN(C)C=C1C=CC=N1
InChIInChI=1S/C7H10N2/c1-9(2)6-7-4-3-5-8-7/h3-6H,1-2H3
InChIKeyOUVWRMOKHVEGJB-UHFFFAOYSA-N
XLogP1.03
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-pyrrol-2-ylidenemethanamine?
The IUPAC name of N,N-dimethyl-1-pyrrol-2-ylidenemethanamine (CID 54170759) is N,N-dimethyl-1-pyrrol-2-ylidenemethanamine.
What is the SMILES notation for N,N-dimethyl-1-pyrrol-2-ylidenemethanamine?
The canonical SMILES for N,N-dimethyl-1-pyrrol-2-ylidenemethanamine is CN(C)C=C1C=CC=N1.
What is the InChIKey of N,N-dimethyl-1-pyrrol-2-ylidenemethanamine?
The InChIKey is OUVWRMOKHVEGJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2/c1-9(2)6-7-4-3-5-8-7/h3-6H,1-2H3.
What are the key properties of N,N-dimethyl-1-pyrrol-2-ylidenemethanamine?
N,N-dimethyl-1-pyrrol-2-ylidenemethanamine has a molecular weight of 122.17 g/mol, XLogP of 1.03, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-pyrrol-2-ylidenemethanamine is sourced from PubChem (CID 54170759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).