N-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine

C13H19N3 — CID 134792970

IUPACN-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine
SMILESCN(Cc1cccn1C)Cc1cccn1C
InChIInChI=1S/C13H19N3/c1-14(10-12-6-4-8-15(12)2)11-13-7-5-9-16(13)3/h4-9H,10-11H2,1-3H3
InChIKeyXETWGVUCRKHXPQ-UHFFFAOYSA-N
MW217.32 g/mol
LogP2.00
Rot. Bonds4

About N-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine

N-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine (PubChem CID 134792970) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is N-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine
PubChem CID134792970
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC NameN-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine
SMILESCN(Cc1cccn1C)Cc1cccn1C
InChIInChI=1S/C13H19N3/c1-14(10-12-6-4-8-15(12)2)11-13-7-5-9-16(13)3/h4-9H,10-11H2,1-3H3
InChIKeyXETWGVUCRKHXPQ-UHFFFAOYSA-N
XLogP2.00
TPSA13.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine?
The IUPAC name of N-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine (CID 134792970) is N-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine.
What is the SMILES notation for N-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine?
The canonical SMILES for N-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine is CN(Cc1cccn1C)Cc1cccn1C.
What is the InChIKey of N-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine?
The InChIKey is XETWGVUCRKHXPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-14(10-12-6-4-8-15(12)2)11-13-7-5-9-16(13)3/h4-9H,10-11H2,1-3H3.
What are the key properties of N-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine?
N-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine has a molecular weight of 217.32 g/mol, XLogP of 2.00, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylpyrrol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine is sourced from PubChem (CID 134792970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).