2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol

C10H13BrN4O — CID 123576710

IUPAC2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol
SMILESCCN1c2nc(N)nc(C)c2C=C(Br)C1O
InChIInChI=1S/C10H13BrN4O/c1-3-15-8-6(4-7(11)9(15)16)5(2)13-10(12)14-8/h4,9,16H,3H2,1-2H3,(H2,12,13,14)
InChIKeyKBMUBJNCHQYIHA-UHFFFAOYSA-N
MW285.14 g/mol
LogP1.26
Rot. Bonds1

About 2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol

2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol (PubChem CID 123576710) has the molecular formula C10H13BrN4O and a molecular weight of 285.14 g/mol. Its IUPAC name is 2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol.

Molecular Properties

Compound Name2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol
PubChem CID123576710
Molecular FormulaC10H13BrN4O
Molecular Weight285.14 g/mol
Exact Mass284.03
IUPAC Name2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol
SMILESCCN1c2nc(N)nc(C)c2C=C(Br)C1O
InChIInChI=1S/C10H13BrN4O/c1-3-15-8-6(4-7(11)9(15)16)5(2)13-10(12)14-8/h4,9,16H,3H2,1-2H3,(H2,12,13,14)
InChIKeyKBMUBJNCHQYIHA-UHFFFAOYSA-N
XLogP1.26
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.14
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-yl)-N',N'-dimethylpropane-1,3-diamine
CID 67389320
3-[6-bromo-2-(ethylamino)-4-methyl-7H-pyrido[2,3-d]pyrimidin-8-yl]propan-1-ol
CID 69009238
6-bromo-8-(2-ethoxyethyl)-N-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine
CID 69009692
6-bromo-N-ethyl-8-(3-methoxypropyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine
CID 69010230
6-bromo-8-(3-ethoxypropyl)-N-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine
CID 69010542
6-bromo-8-(3-ethoxypropyl)-2-(ethylamino)-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol
CID 123189410
6-bromo-2-(ethylamino)-8-(3-hydroxypropyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol
CID 123434019
2-(ethylamino)-4,6-dimethyl-8-(3-propan-2-yloxypropyl)-7H-pyrido[2,3-d]pyrimidin-7-ol
CID 123471821
CID 123809707
CID 123809707
6-bromo-4-methyl-2-(2-methylpropylamino)-8-propan-2-yl-7H-pyrido[2,3-d]pyrimidin-7-ol
CID 123850541
6-bromo-2-(ethylamino)-4-methyl-8-(3-propan-2-yloxypropyl)-7H-pyrido[2,3-d]pyrimidin-7-ol
CID 137384078
8-cyclohexyl-2-(ethylamino)-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol
CID 137384082

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol?
The IUPAC name of 2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol (CID 123576710) is 2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol.
What is the SMILES notation for 2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol?
The canonical SMILES for 2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol is CCN1c2nc(N)nc(C)c2C=C(Br)C1O.
What is the InChIKey of 2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol?
The InChIKey is KBMUBJNCHQYIHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN4O/c1-3-15-8-6(4-7(11)9(15)16)5(2)13-10(12)14-8/h4,9,16H,3H2,1-2H3,(H2,12,13,14).
What are the key properties of 2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol?
2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol has a molecular weight of 285.14 g/mol, XLogP of 1.26, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-bromo-8-ethyl-4-methyl-7H-pyrido[2,3-d]pyrimidin-7-ol is sourced from PubChem (CID 123576710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).