7-(2-methylpropyl)quinazoline

C12H14N2 — CID 147255984

IUPAC7-(2-methylpropyl)quinazoline
SMILESCC(C)Cc1ccc2cncnc2c1
InChIInChI=1S/C12H14N2/c1-9(2)5-10-3-4-11-7-13-8-14-12(11)6-10/h3-4,6-9H,5H2,1-2H3
InChIKeyCNPXPBCESAIFAA-UHFFFAOYSA-N
MW186.26 g/mol
LogP2.83
Rot. Bonds2

About 7-(2-methylpropyl)quinazoline

7-(2-methylpropyl)quinazoline (PubChem CID 147255984) has the molecular formula C12H14N2 and a molecular weight of 186.26 g/mol. Its IUPAC name is 7-(2-methylpropyl)quinazoline.

Molecular Properties

Compound Name7-(2-methylpropyl)quinazoline
PubChem CID147255984
Molecular FormulaC12H14N2
Molecular Weight186.26 g/mol
Exact Mass186.12
IUPAC Name7-(2-methylpropyl)quinazoline
SMILESCC(C)Cc1ccc2cncnc2c1
InChIInChI=1S/C12H14N2/c1-9(2)5-10-3-4-11-7-13-8-14-12(11)6-10/h3-4,6-9H,5H2,1-2H3
InChIKeyCNPXPBCESAIFAA-UHFFFAOYSA-N
XLogP2.83
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.26
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-(2-methylpropyl)-2-propan-2-ylindazole
CID 155051024
N-(2-methylpropyl)quinazoline-7-carboxamide
CID 122423883
7-tert-butylquinazoline
CID 58717381
ethene;7-methylquinazoline
CID 145317995
7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline
CID 151497293
6-(2-methylpropyl)-1,2,3,4-benzotetrazine
CID 138666997
6-(2-methylpropyl)-1-propan-2-ylindazole
CID 138583309
3-chloro-7-(2-methylpropyl)quinolin-2-amine
CID 166974012
4-bromo-5-[3-(2-methylpropyl)phenyl]pyrimidine
CID 105371570
7-(2-methylpropyl)-3-phenylisoquinoline
CID 170528428
2-hydroxypropanoic acid;quinazoline
CID 157213189
5-(2-methylpropyl)-2-propan-2-yl-1,3-benzothiazole
CID 134533017

Frequently Asked Questions

What is the IUPAC name of 7-(2-methylpropyl)quinazoline?
The IUPAC name of 7-(2-methylpropyl)quinazoline (CID 147255984) is 7-(2-methylpropyl)quinazoline.
What is the SMILES notation for 7-(2-methylpropyl)quinazoline?
The canonical SMILES for 7-(2-methylpropyl)quinazoline is CC(C)Cc1ccc2cncnc2c1.
What is the InChIKey of 7-(2-methylpropyl)quinazoline?
The InChIKey is CNPXPBCESAIFAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2/c1-9(2)5-10-3-4-11-7-13-8-14-12(11)6-10/h3-4,6-9H,5H2,1-2H3.
What are the key properties of 7-(2-methylpropyl)quinazoline?
7-(2-methylpropyl)quinazoline has a molecular weight of 186.26 g/mol, XLogP of 2.83, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methylpropyl)quinazoline is sourced from PubChem (CID 147255984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).