7a-methyl-8H-cyclopropa[e]quinazoline

C10H10N2 — CID 143949901

IUPAC7a-methyl-8H-cyclopropa[e]quinazoline
SMILESCC12C=CC=C3N=CN=CC31C2
InChIInChI=1S/C10H10N2/c1-9-4-2-3-8-10(9,5-9)6-11-7-12-8/h2-4,6-7H,5H2,1H3
InChIKeyUXHTYJJRVUMZGL-UHFFFAOYSA-N
MW158.20 g/mol
LogP1.95
Rot. Bonds

About 7a-methyl-8H-cyclopropa[e]quinazoline

7a-methyl-8H-cyclopropa[e]quinazoline (PubChem CID 143949901) has the molecular formula C10H10N2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 7a-methyl-8H-cyclopropa[e]quinazoline.

Molecular Properties

Compound Name7a-methyl-8H-cyclopropa[e]quinazoline
PubChem CID143949901
Molecular FormulaC10H10N2
Molecular Weight158.20 g/mol
Exact Mass158.08
IUPAC Name7a-methyl-8H-cyclopropa[e]quinazoline
SMILESCC12C=CC=C3N=CN=CC31C2
InChIInChI=1S/C10H10N2/c1-9-4-2-3-8-10(9,5-9)6-11-7-12-8/h2-4,6-7H,5H2,1H3
InChIKeyUXHTYJJRVUMZGL-UHFFFAOYSA-N
XLogP1.95
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7a-methyl-8H-cyclopropa[e]quinazoline?
The IUPAC name of 7a-methyl-8H-cyclopropa[e]quinazoline (CID 143949901) is 7a-methyl-8H-cyclopropa[e]quinazoline.
What is the SMILES notation for 7a-methyl-8H-cyclopropa[e]quinazoline?
The canonical SMILES for 7a-methyl-8H-cyclopropa[e]quinazoline is CC12C=CC=C3N=CN=CC31C2.
What is the InChIKey of 7a-methyl-8H-cyclopropa[e]quinazoline?
The InChIKey is UXHTYJJRVUMZGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2/c1-9-4-2-3-8-10(9,5-9)6-11-7-12-8/h2-4,6-7H,5H2,1H3.
What are the key properties of 7a-methyl-8H-cyclopropa[e]quinazoline?
7a-methyl-8H-cyclopropa[e]quinazoline has a molecular weight of 158.20 g/mol, XLogP of 1.95, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7a-methyl-8H-cyclopropa[e]quinazoline is sourced from PubChem (CID 143949901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).