8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole

C15H13N3 — CID 71408712

IUPAC8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole
SMILESCc1cccc2c3c([nH]c12)CCc1cncnc1-3
InChIInChI=1S/C15H13N3/c1-9-3-2-4-11-13-12(18-14(9)11)6-5-10-7-16-8-17-15(10)13/h2-4,7-8,18H,5-6H2,1H3
InChIKeyJTOOHDKRSLVNSY-UHFFFAOYSA-N
MW235.29 g/mol
LogP3.03
Rot. Bonds

About 8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole

8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole (PubChem CID 71408712) has the molecular formula C15H13N3 and a molecular weight of 235.29 g/mol. Its IUPAC name is 8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole.

Molecular Properties

Compound Name8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole
PubChem CID71408712
Molecular FormulaC15H13N3
Molecular Weight235.29 g/mol
Exact Mass235.11
IUPAC Name8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole
SMILESCc1cccc2c3c([nH]c12)CCc1cncnc1-3
InChIInChI=1S/C15H13N3/c1-9-3-2-4-11-13-12(18-14(9)11)6-5-10-7-16-8-17-15(10)13/h2-4,7-8,18H,5-6H2,1H3
InChIKeyJTOOHDKRSLVNSY-UHFFFAOYSA-N
XLogP3.03
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole?
The IUPAC name of 8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole (CID 71408712) is 8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole.
What is the SMILES notation for 8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole?
The canonical SMILES for 8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole is Cc1cccc2c3c([nH]c12)CCc1cncnc1-3.
What is the InChIKey of 8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole?
The InChIKey is JTOOHDKRSLVNSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3/c1-9-3-2-4-11-13-12(18-14(9)11)6-5-10-7-16-8-17-15(10)13/h2-4,7-8,18H,5-6H2,1H3.
What are the key properties of 8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole?
8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole has a molecular weight of 235.29 g/mol, XLogP of 3.03, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-6,7-dihydro-5H-pyrimido[5,4-c]carbazole is sourced from PubChem (CID 71408712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).