2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine

C19H25N5O — CID 56740575

IUPAC2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine
SMILESNCCC1CN(c2nc(-c3ccccc3)nc3c2CCNC3)CCO1
InChIInChI=1S/C19H25N5O/c20-8-6-15-13-24(10-11-25-15)19-16-7-9-21-12-17(16)22-18(23-19)14-4-2-1-3-5-14/h1-5,15,21H,6-13,20H2
InChIKeyINVBUMHIAGEZBW-UHFFFAOYSA-N
MW339.44 g/mol
LogP1.34
Rot. Bonds4

About 2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine

2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine (PubChem CID 56740575) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is 2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine.

Molecular Properties

Compound Name2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine
PubChem CID56740575
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine
SMILESNCCC1CN(c2nc(-c3ccccc3)nc3c2CCNC3)CCO1
InChIInChI=1S/C19H25N5O/c20-8-6-15-13-24(10-11-25-15)19-16-7-9-21-12-17(16)22-18(23-19)14-4-2-1-3-5-14/h1-5,15,21H,6-13,20H2
InChIKeyINVBUMHIAGEZBW-UHFFFAOYSA-N
XLogP1.34
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine 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-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine?
The IUPAC name of 2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine (CID 56740575) is 2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine.
What is the SMILES notation for 2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine?
The canonical SMILES for 2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine is NCCC1CN(c2nc(-c3ccccc3)nc3c2CCNC3)CCO1.
What is the InChIKey of 2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine?
The InChIKey is INVBUMHIAGEZBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c20-8-6-15-13-24(10-11-25-15)19-16-7-9-21-12-17(16)22-18(23-19)14-4-2-1-3-5-14/h1-5,15,21H,6-13,20H2.
What are the key properties of 2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine?
2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine has a molecular weight of 339.44 g/mol, XLogP of 1.34, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-phenyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)morpholin-2-yl]ethanamine is sourced from PubChem (CID 56740575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).