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

C11H15N5O — CID 19436890

IUPAC(2,4-diamino-5-propylpyrido[2,3-d]pyrimidin-6-yl)methanol
SMILESCCCc1c(CO)cnc2nc(N)nc(N)c12
InChIInChI=1S/C11H15N5O/c1-2-3-7-6(5-17)4-14-10-8(7)9(12)15-11(13)16-10/h4,17H,2-3,5H2,1H3,(H4,12,13,14,15,16)
InChIKeyGDDOBDUGMHCRKQ-UHFFFAOYSA-N
MW233.27 g/mol
LogP0.63
Rot. Bonds3

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

(2,4-diamino-5-propylpyrido[2,3-d]pyrimidin-6-yl)methanol (PubChem CID 19436890) has the molecular formula C11H15N5O and a molecular weight of 233.27 g/mol. Its IUPAC name is (2,4-diamino-5-propylpyrido[2,3-d]pyrimidin-6-yl)methanol.

Molecular Properties

Compound Name(2,4-diamino-5-propylpyrido[2,3-d]pyrimidin-6-yl)methanol
PubChem CID19436890
Molecular FormulaC11H15N5O
Molecular Weight233.27 g/mol
Exact Mass233.13
IUPAC Name(2,4-diamino-5-propylpyrido[2,3-d]pyrimidin-6-yl)methanol
SMILESCCCc1c(CO)cnc2nc(N)nc(N)c12
InChIInChI=1S/C11H15N5O/c1-2-3-7-6(5-17)4-14-10-8(7)9(12)15-11(13)16-10/h4,17H,2-3,5H2,1H3,(H4,12,13,14,15,16)
InChIKeyGDDOBDUGMHCRKQ-UHFFFAOYSA-N
XLogP0.63
TPSA110.94 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 50.63
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-propylpyrido[2,3-d]pyrimidin-6-yl)methanol?
The IUPAC name of (2,4-diamino-5-propylpyrido[2,3-d]pyrimidin-6-yl)methanol (CID 19436890) is (2,4-diamino-5-propylpyrido[2,3-d]pyrimidin-6-yl)methanol.
What is the SMILES notation for (2,4-diamino-5-propylpyrido[2,3-d]pyrimidin-6-yl)methanol?
The canonical SMILES for (2,4-diamino-5-propylpyrido[2,3-d]pyrimidin-6-yl)methanol is CCCc1c(CO)cnc2nc(N)nc(N)c12.
What is the InChIKey of (2,4-diamino-5-propylpyrido[2,3-d]pyrimidin-6-yl)methanol?
The InChIKey is GDDOBDUGMHCRKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-2-3-7-6(5-17)4-14-10-8(7)9(12)15-11(13)16-10/h4,17H,2-3,5H2,1H3,(H4,12,13,14,15,16).
What are the key properties of (2,4-diamino-5-propylpyrido[2,3-d]pyrimidin-6-yl)methanol?
(2,4-diamino-5-propylpyrido[2,3-d]pyrimidin-6-yl)methanol has a molecular weight of 233.27 g/mol, XLogP of 0.63, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-diamino-5-propylpyrido[2,3-d]pyrimidin-6-yl)methanol is sourced from PubChem (CID 19436890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).