2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine

C15H25N5O — CID 92565073

IUPAC2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine
SMILESCc1nc2c(c(NCCN3CCOCC3)n1)CCN(C)C2
InChIInChI=1S/C15H25N5O/c1-12-17-14-11-19(2)5-3-13(14)15(18-12)16-4-6-20-7-9-21-10-8-20/h3-11H2,1-2H3,(H,16,17,18)
InChIKeyQISLTRULDLQZBJ-UHFFFAOYSA-N
MW291.40 g/mol
LogP0.52
Rot. Bonds4

About 2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine

2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine (PubChem CID 92565073) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is 2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine
PubChem CID92565073
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC Name2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine
SMILESCc1nc2c(c(NCCN3CCOCC3)n1)CCN(C)C2
InChIInChI=1S/C15H25N5O/c1-12-17-14-11-19(2)5-3-13(14)15(18-12)16-4-6-20-7-9-21-10-8-20/h3-11H2,1-2H3,(H,16,17,18)
InChIKeyQISLTRULDLQZBJ-UHFFFAOYSA-N
XLogP0.52
TPSA53.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine?
The IUPAC name of 2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine (CID 92565073) is 2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine is Cc1nc2c(c(NCCN3CCOCC3)n1)CCN(C)C2.
What is the InChIKey of 2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine?
The InChIKey is QISLTRULDLQZBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O/c1-12-17-14-11-19(2)5-3-13(14)15(18-12)16-4-6-20-7-9-21-10-8-20/h3-11H2,1-2H3,(H,16,17,18).
What are the key properties of 2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine?
2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine has a molecular weight of 291.40 g/mol, XLogP of 0.52, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethyl-N-(2-morpholin-4-ylethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 92565073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).