1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine

C12H15N3O — CID 105471322

IUPAC1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine
SMILESCOc1ccc2c(C)nc(C(C)N)nc2c1
InChIInChI=1S/C12H15N3O/c1-7(13)12-14-8(2)10-5-4-9(16-3)6-11(10)15-12/h4-7H,13H2,1-3H3
InChIKeySRPAQYQPNUXTEA-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.97
Rot. Bonds2

About 1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine

1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine (PubChem CID 105471322) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine.

Molecular Properties

Compound Name1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine
PubChem CID105471322
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine
SMILESCOc1ccc2c(C)nc(C(C)N)nc2c1
InChIInChI=1S/C12H15N3O/c1-7(13)12-14-8(2)10-5-4-9(16-3)6-11(10)15-12/h4-7H,13H2,1-3H3
InChIKeySRPAQYQPNUXTEA-UHFFFAOYSA-N
XLogP1.97
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-7-methoxy-2-propan-2-ylquinazoline
CID 106584178
N-(4,6-dimethylpyrimidin-2-yl)-7-methoxy-4-methylquinazolin-2-amine
CID 658255
7-methoxy-4-methylquinolin-2-amine
CID 53485904
3-(7-methoxy-4-methylquinolin-2-yl)-2-methylpropan-1-amine
CID 82576819
3,6-dimethoxy-1-methylisoquinoline
CID 169285036
1-(6-methoxy-2-methylquinazolin-4-yl)ethanamine
CID 105471312
1-(6-methoxy-2H-indazol-3-yl)propan-2-amine
CID 83908741
6-methoxy-10-methyl-12-oxa-9-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaene
CID 170838380
2-cyclopropyl-7-methoxy-4-propan-2-yloxyquinoline
CID 58755688
7-methoxy-2,3-dimethylquinoline
CID 58717059
4-bromo-7-methoxy-2-methylquinoline
CID 11550580
4-bromo-3-iodo-7-methoxy-2-methylquinoline
CID 121236808

Frequently Asked Questions

What is the IUPAC name of 1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine?
The IUPAC name of 1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine (CID 105471322) is 1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine.
What is the SMILES notation for 1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine?
The canonical SMILES for 1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine is COc1ccc2c(C)nc(C(C)N)nc2c1.
What is the InChIKey of 1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine?
The InChIKey is SRPAQYQPNUXTEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-7(13)12-14-8(2)10-5-4-9(16-3)6-11(10)15-12/h4-7H,13H2,1-3H3.
What are the key properties of 1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine?
1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine has a molecular weight of 217.27 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-methoxy-4-methylquinazolin-2-yl)ethanamine is sourced from PubChem (CID 105471322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).