6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine

C11H11BrClN3 — CID 114692800

IUPAC6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine
SMILESCC(C)Nc1nc(Cl)nc2ccc(Br)cc12
InChIInChI=1S/C11H11BrClN3/c1-6(2)14-10-8-5-7(12)3-4-9(8)15-11(13)16-10/h3-6H,1-2H3,(H,14,15,16)
InChIKeyGHGKAIKBRVYMHN-UHFFFAOYSA-N
MW300.59 g/mol
LogP3.87
Rot. Bonds2

About 6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine

6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine (PubChem CID 114692800) has the molecular formula C11H11BrClN3 and a molecular weight of 300.59 g/mol. Its IUPAC name is 6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine.

Molecular Properties

Compound Name6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine
PubChem CID114692800
Molecular FormulaC11H11BrClN3
Molecular Weight300.59 g/mol
Exact Mass298.98
IUPAC Name6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine
SMILESCC(C)Nc1nc(Cl)nc2ccc(Br)cc12
InChIInChI=1S/C11H11BrClN3/c1-6(2)14-10-8-5-7(12)3-4-9(8)15-11(13)16-10/h3-6H,1-2H3,(H,14,15,16)
InChIKeyGHGKAIKBRVYMHN-UHFFFAOYSA-N
XLogP3.87
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.59
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-6-ethyl-N-propan-2-ylquinazolin-4-amine
CID 114693032
N-(6-bromo-2-chloroquinazolin-4-yl)acetamide
CID 133061494
2,7-dichloro-N-propan-2-ylquinazolin-4-amine
CID 114693126
6-bromo-4-chloro-2-methoxy-3-(2-methylpropyl)quinoline
CID 118022089
6-bromo-N-propan-2-ylquinolin-4-amine
CID 150956944
2-(4-bromophenyl)-N-propan-2-ylquinazolin-4-amine
CID 869819
(6-bromo-2-propan-2-ylquinazolin-4-yl)hydrazine
CID 106583906
N-(5-bromo-2-chlorophenyl)-2-chloroquinazolin-4-amine
CID 63548575
6-bromo-4-(propan-2-ylamino)cinnoline-3-carboxylic acid
CID 138490804
2-N-(4-bromophenyl)-4-N-propan-2-ylquinazoline-2,4-diamine
CID 91966058
2-chloro-6-fluoro-8-methyl-N-propan-2-ylquinazolin-4-amine
CID 114693172
2-chloro-7-fluoro-8-methyl-N-propan-2-ylquinazolin-4-amine
CID 114693358

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine?
The IUPAC name of 6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine (CID 114692800) is 6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine.
What is the SMILES notation for 6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine?
The canonical SMILES for 6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine is CC(C)Nc1nc(Cl)nc2ccc(Br)cc12.
What is the InChIKey of 6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine?
The InChIKey is GHGKAIKBRVYMHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrClN3/c1-6(2)14-10-8-5-7(12)3-4-9(8)15-11(13)16-10/h3-6H,1-2H3,(H,14,15,16).
What are the key properties of 6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine?
6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine has a molecular weight of 300.59 g/mol, XLogP of 3.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-chloro-N-propan-2-ylquinazolin-4-amine is sourced from PubChem (CID 114692800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).