[2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol

C24H29N5O4 — CID 146626004

IUPAC[2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol
SMILESCOc1ccc(-c2ccc3c(N4CCOCC4)nc(N4CCOC[C@H]4C)nc3n2)cc1CO
InChIInChI=1S/C24H29N5O4/c1-16-15-33-12-9-29(16)24-26-22-19(23(27-24)28-7-10-32-11-8-28)4-5-20(25-22)17-3-6-21(31-2)18(13-17)14-30/h3-6,13,16,30H,7-12,14-15H2,1-2H3/t16-/m1/s1
InChIKeyKGMIPMKEFCFDKI-MRXNPFEDSA-N
MW451.53 g/mol
LogP2.25
Rot. Bonds5

About [2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol

[2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol (PubChem CID 146626004) has the molecular formula C24H29N5O4 and a molecular weight of 451.53 g/mol. Its IUPAC name is [2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol.

Molecular Properties

Compound Name[2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol
PubChem CID146626004
Molecular FormulaC24H29N5O4
Molecular Weight451.53 g/mol
Exact Mass451.22
IUPAC Name[2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol
SMILESCOc1ccc(-c2ccc3c(N4CCOCC4)nc(N4CCOC[C@H]4C)nc3n2)cc1CO
InChIInChI=1S/C24H29N5O4/c1-16-15-33-12-9-29(16)24-26-22-19(23(27-24)28-7-10-32-11-8-28)4-5-20(25-22)17-3-6-21(31-2)18(13-17)14-30/h3-6,13,16,30H,7-12,14-15H2,1-2H3/t16-/m1/s1
InChIKeyKGMIPMKEFCFDKI-MRXNPFEDSA-N
XLogP2.25
TPSA93.07 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.53
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze [2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol?
The IUPAC name of [2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol (CID 146626004) is [2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol.
What is the SMILES notation for [2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol?
The canonical SMILES for [2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol is COc1ccc(-c2ccc3c(N4CCOCC4)nc(N4CCOC[C@H]4C)nc3n2)cc1CO.
What is the InChIKey of [2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol?
The InChIKey is KGMIPMKEFCFDKI-MRXNPFEDSA-N. The full InChI is InChI=1S/C24H29N5O4/c1-16-15-33-12-9-29(16)24-26-22-19(23(27-24)28-7-10-32-11-8-28)4-5-20(25-22)17-3-6-21(31-2)18(13-17)14-30/h3-6,13,16,30H,7-12,14-15H2,1-2H3/t16-/m1/s1.
What are the key properties of [2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol?
[2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol has a molecular weight of 451.53 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxy-5-[2-[(3R)-3-methylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]phenyl]methanol is sourced from PubChem (CID 146626004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).