1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine

C12H12BrN3 — CID 84811348

IUPAC1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine
SMILESCc1nc(C2(N)CC2)nc2cc(Br)ccc12
InChIInChI=1S/C12H12BrN3/c1-7-9-3-2-8(13)6-10(9)16-11(15-7)12(14)4-5-12/h2-3,6H,4-5,14H2,1H3
InChIKeyUWHYRAFDGDKGJK-UHFFFAOYSA-N
MW278.15 g/mol
LogP2.65
Rot. Bonds1

About 1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine

1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine (PubChem CID 84811348) has the molecular formula C12H12BrN3 and a molecular weight of 278.15 g/mol. Its IUPAC name is 1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine
PubChem CID84811348
Molecular FormulaC12H12BrN3
Molecular Weight278.15 g/mol
Exact Mass277.02
IUPAC Name1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine
SMILESCc1nc(C2(N)CC2)nc2cc(Br)ccc12
InChIInChI=1S/C12H12BrN3/c1-7-9-3-2-8(13)6-10(9)16-11(15-7)12(14)4-5-12/h2-3,6H,4-5,14H2,1H3
InChIKeyUWHYRAFDGDKGJK-UHFFFAOYSA-N
XLogP2.65
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.15
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(7-bromo-4-methylquinazolin-2-yl)propan-1-amine
CID 84811803
1-(5-bromo-2H-indazol-3-yl)cyclopropan-1-amine
CID 175349705
7-bromo-3,4-diethyl-2-methylquinoline
CID 125453419
1-(5-bromo-1-methylbenzimidazol-2-yl)cyclohexan-1-amine
CID 61290827
1-(6-bromo-2-methoxynaphthalen-1-yl)cyclopropan-1-amine
CID 84814976
(7-bromo-2-methylquinolin-4-yl)hydrazine
CID 17040022
7-bromo-4-chloro-2-methylquinoline
CID 17040020
7-bromo-2-chloro-4-methylquinoline
CID 14570303
3-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]-6-bromo-4-methylchromen-2-one
CID 120851862
1-(4-methoxy-5-methylquinazolin-2-yl)cyclopropan-1-amine
CID 84792799
1-[4-(2-bromophenyl)-6-methylpyrimidin-2-yl]cyclopropan-1-amine
CID 116896707
7-bromo-4-methoxy-2-methylquinoline
CID 82581190

Frequently Asked Questions

What is the IUPAC name of 1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine?
The IUPAC name of 1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine (CID 84811348) is 1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine.
What is the SMILES notation for 1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine?
The canonical SMILES for 1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine is Cc1nc(C2(N)CC2)nc2cc(Br)ccc12.
What is the InChIKey of 1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine?
The InChIKey is UWHYRAFDGDKGJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12BrN3/c1-7-9-3-2-8(13)6-10(9)16-11(15-7)12(14)4-5-12/h2-3,6H,4-5,14H2,1H3.
What are the key properties of 1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine?
1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine has a molecular weight of 278.15 g/mol, XLogP of 2.65, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-bromo-4-methylquinazolin-2-yl)cyclopropan-1-amine is sourced from PubChem (CID 84811348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).