1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine

C8H13N3 — CID 96635890

IUPAC1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine
SMILESCNCc1cnc2n1CCC2
InChIInChI=1S/C8H13N3/c1-9-5-7-6-10-8-3-2-4-11(7)8/h6,9H,2-5H2,1H3
InChIKeyYCWOQJGTOWNPJR-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.55
Rot. Bonds2

About 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine

1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine (PubChem CID 96635890) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine
PubChem CID96635890
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine
SMILESCNCc1cnc2n1CCC2
InChIInChI=1S/C8H13N3/c1-9-5-7-6-10-8-3-2-4-11(7)8/h6,9H,2-5H2,1H3
InChIKeyYCWOQJGTOWNPJR-UHFFFAOYSA-N
XLogP0.55
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine (CID 96635890) is 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine is CNCc1cnc2n1CCC2.
What is the InChIKey of 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine?
The InChIKey is YCWOQJGTOWNPJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-9-5-7-6-10-8-3-2-4-11(7)8/h6,9H,2-5H2,1H3.
What are the key properties of 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine?
1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine has a molecular weight of 151.21 g/mol, XLogP of 0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)-N-methylmethanamine is sourced from PubChem (CID 96635890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).