2-methylquinoline;pyrimidine

C14H13N3 — CID 174933863

IUPAC2-methylquinoline;pyrimidine
SMILESCc1ccc2ccccc2n1.c1cncnc1
InChIInChI=1S/C10H9N.C4H4N2/c1-8-6-7-9-4-2-3-5-10(9)11-8;1-2-5-4-6-3-1/h2-7H,1H3;1-4H
InChIKeyNXRJNGNVNBTQRQ-UHFFFAOYSA-N
MW223.28 g/mol
LogP3.02
Rot. Bonds

About 2-methylquinoline;pyrimidine

2-methylquinoline;pyrimidine (PubChem CID 174933863) has the molecular formula C14H13N3 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-methylquinoline;pyrimidine.

Molecular Properties

Compound Name2-methylquinoline;pyrimidine
PubChem CID174933863
Molecular FormulaC14H13N3
Molecular Weight223.28 g/mol
Exact Mass223.11
IUPAC Name2-methylquinoline;pyrimidine
SMILESCc1ccc2ccccc2n1.c1cncnc1
InChIInChI=1S/C10H9N.C4H4N2/c1-8-6-7-9-4-2-3-5-10(9)11-8;1-2-5-4-6-3-1/h2-7H,1H3;1-4H
InChIKeyNXRJNGNVNBTQRQ-UHFFFAOYSA-N
XLogP3.02
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;methane;2-methylquinoline
CID 144748871
2-methylquinoline;naphthalene;hydrochloride
CID 175029103
dichloroplatinum;bis(2-methylquinoline)
CID 50909727
potassium;hydride;2-methylquinoline;tritetrafluoroborate
CID 175190029
dihydroxy(oxo)phosphanium;2-methylquinoline
CID 174867800
1-chloronaphthalene;2-methylquinoline
CID 175049880
2-methylquinoline;quinoline-2-carboxamide
CID 174829911
bis(2-methylquinoline);triphenylsilyloxyaluminum(2+)
CID 162162913
butane-1,3-diol;2-methylquinoline
CID 141397242
2-methylbenzo[b][1,8]naphthyridine
CID 118895198
2-methylbenzo[b][1,10]phenanthroline
CID 11615688
benzene;ethane;icosakis(2-methylpropane);naphthalene;pentakis(pyrimidine)
CID 159918770

Frequently Asked Questions

What is the IUPAC name of 2-methylquinoline;pyrimidine?
The IUPAC name of 2-methylquinoline;pyrimidine (CID 174933863) is 2-methylquinoline;pyrimidine.
What is the SMILES notation for 2-methylquinoline;pyrimidine?
The canonical SMILES for 2-methylquinoline;pyrimidine is Cc1ccc2ccccc2n1.c1cncnc1.
What is the InChIKey of 2-methylquinoline;pyrimidine?
The InChIKey is NXRJNGNVNBTQRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N.C4H4N2/c1-8-6-7-9-4-2-3-5-10(9)11-8;1-2-5-4-6-3-1/h2-7H,1H3;1-4H.
What are the key properties of 2-methylquinoline;pyrimidine?
2-methylquinoline;pyrimidine has a molecular weight of 223.28 g/mol, XLogP of 3.02, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylquinoline;pyrimidine is sourced from PubChem (CID 174933863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).