6-bromo-N-cyclopentylquinazolin-2-amine

C13H14BrN3 — CID 118048975

IUPAC6-bromo-N-cyclopentylquinazolin-2-amine
SMILESBrc1ccc2nc(NC3CCCC3)ncc2c1
InChIInChI=1S/C13H14BrN3/c14-10-5-6-12-9(7-10)8-15-13(17-12)16-11-3-1-2-4-11/h5-8,11H,1-4H2,(H,15,16,17)
InChIKeyHPJAYMVAAKAERF-UHFFFAOYSA-N
MW292.18 g/mol
LogP3.75
Rot. Bonds2

About 6-bromo-N-cyclopentylquinazolin-2-amine

6-bromo-N-cyclopentylquinazolin-2-amine (PubChem CID 118048975) has the molecular formula C13H14BrN3 and a molecular weight of 292.18 g/mol. Its IUPAC name is 6-bromo-N-cyclopentylquinazolin-2-amine.

Molecular Properties

Compound Name6-bromo-N-cyclopentylquinazolin-2-amine
PubChem CID118048975
Molecular FormulaC13H14BrN3
Molecular Weight292.18 g/mol
Exact Mass291.04
IUPAC Name6-bromo-N-cyclopentylquinazolin-2-amine
SMILESBrc1ccc2nc(NC3CCCC3)ncc2c1
InChIInChI=1S/C13H14BrN3/c14-10-5-6-12-9(7-10)8-15-13(17-12)16-11-3-1-2-4-11/h5-8,11H,1-4H2,(H,15,16,17)
InChIKeyHPJAYMVAAKAERF-UHFFFAOYSA-N
XLogP3.75
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.18
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-6-methylquinazolin-2-amine
CID 176973176
N-cyclohexyl-6-methylquinazolin-2-amine
CID 156833151
3-[(6-bromoquinazolin-2-yl)amino]piperidine-1-carboxylic acid
CID 155391404
6-bromo-N-(1-methylpyrazol-4-yl)quinazolin-2-amine
CID 155777536
6-bromo-N-[(1-ethylpiperidin-4-yl)methyl]quinazolin-2-amine
CID 58829493
4-[2-(cyclopentylamino)quinazolin-6-yl]oxy-N-methylpyridine-2-carboxamide
CID 42642424
5-bromo-N-cyclohexyl-4-methylpyrimidin-2-amine
CID 115050366
6-bromo-N-cyclohexyl-2-iodoquinazolin-4-amine
CID 89299405
6-bromo-4-N-cyclopentylquinoline-3,4-diamine
CID 43621174
N-(oxan-4-yl)quinazolin-2-amine
CID 114788886
5-bromo-N-cyclopropylquinazolin-2-amine
CID 165498561
6-bromo-N-cyclobutylnaphthalen-2-amine
CID 81260482

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-cyclopentylquinazolin-2-amine?
The IUPAC name of 6-bromo-N-cyclopentylquinazolin-2-amine (CID 118048975) is 6-bromo-N-cyclopentylquinazolin-2-amine.
What is the SMILES notation for 6-bromo-N-cyclopentylquinazolin-2-amine?
The canonical SMILES for 6-bromo-N-cyclopentylquinazolin-2-amine is Brc1ccc2nc(NC3CCCC3)ncc2c1.
What is the InChIKey of 6-bromo-N-cyclopentylquinazolin-2-amine?
The InChIKey is HPJAYMVAAKAERF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrN3/c14-10-5-6-12-9(7-10)8-15-13(17-12)16-11-3-1-2-4-11/h5-8,11H,1-4H2,(H,15,16,17).
What are the key properties of 6-bromo-N-cyclopentylquinazolin-2-amine?
6-bromo-N-cyclopentylquinazolin-2-amine has a molecular weight of 292.18 g/mol, XLogP of 3.75, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-cyclopentylquinazolin-2-amine is sourced from PubChem (CID 118048975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).