(2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol

C10H13N5O — CID 14077655

IUPAC(2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol
SMILESCc1nc2nc(N)nc(N)c2c(C)c1CO
InChIInChI=1S/C10H13N5O/c1-4-6(3-16)5(2)13-9-7(4)8(11)14-10(12)15-9/h16H,3H2,1-2H3,(H4,11,12,13,14,15)
InChIKeySDTQXXHFYRSDFC-UHFFFAOYSA-N
MW219.25 g/mol
LogP0.30
Rot. Bonds1

About (2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol

(2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol (PubChem CID 14077655) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is (2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol.

Molecular Properties

Compound Name(2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol
PubChem CID14077655
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name(2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol
SMILESCc1nc2nc(N)nc(N)c2c(C)c1CO
InChIInChI=1S/C10H13N5O/c1-4-6(3-16)5(2)13-9-7(4)8(11)14-10(12)15-9/h16H,3H2,1-2H3,(H4,11,12,13,14,15)
InChIKeySDTQXXHFYRSDFC-UHFFFAOYSA-N
XLogP0.30
TPSA110.94 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 50.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol?
The IUPAC name of (2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol (CID 14077655) is (2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol.
What is the SMILES notation for (2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol?
The canonical SMILES for (2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol is Cc1nc2nc(N)nc(N)c2c(C)c1CO.
What is the InChIKey of (2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol?
The InChIKey is SDTQXXHFYRSDFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-4-6(3-16)5(2)13-9-7(4)8(11)14-10(12)15-9/h16H,3H2,1-2H3,(H4,11,12,13,14,15).
What are the key properties of (2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol?
(2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol has a molecular weight of 219.25 g/mol, XLogP of 0.30, 1 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-diamino-5,7-dimethylpyrido[2,3-d]pyrimidin-6-yl)methanol is sourced from PubChem (CID 14077655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).