(6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride

C14H25Cl2N5O — CID 82022695

IUPAC(6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride
SMILESCCN1CCc2nc(N3CCOCC3)nc(CN)c2C1.Cl.Cl
InChIInChI=1S/C14H23N5O.2ClH/c1-2-18-4-3-12-11(10-18)13(9-15)17-14(16-12)19-5-7-20-8-6-19;;/h2-10,15H2,1H3;2*1H
InChIKeyWLJMWWGLUPCQGH-UHFFFAOYSA-N
MW350.29 g/mol
LogP0.99
Rot. Bonds3

About (6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride

(6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride (PubChem CID 82022695) has the molecular formula C14H25Cl2N5O and a molecular weight of 350.29 g/mol. Its IUPAC name is (6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride.

Molecular Properties

Compound Name(6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride
PubChem CID82022695
Molecular FormulaC14H25Cl2N5O
Molecular Weight350.29 g/mol
Exact Mass349.14
IUPAC Name(6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride
SMILESCCN1CCc2nc(N3CCOCC3)nc(CN)c2C1.Cl.Cl
InChIInChI=1S/C14H23N5O.2ClH/c1-2-18-4-3-12-11(10-18)13(9-15)17-14(16-12)19-5-7-20-8-6-19;;/h2-10,15H2,1H3;2*1H
InChIKeyWLJMWWGLUPCQGH-UHFFFAOYSA-N
XLogP0.99
TPSA67.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.29
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride with MolForge

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

Launch Full Analysis

Related Compounds

[2-(azepan-1-yl)-6-ethyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]methanamine;dihydrochloride
CID 82022696
[2-(azepan-1-yl)-5,6,7,8-tetrahydroquinazolin-4-yl]methanamine
CID 28908587
4-[6-[(4-chlorophenyl)methyl]-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]morpholine
CID 42870493
2-(4,6-diethyl-2-morpholin-4-ylpyrimidin-5-yl)ethanamine
CID 79220434
4-[4-(2-methylphenoxy)-6-(2-methylpropyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]morpholine
CID 42870585
4-[6-[(2-fluorophenyl)methyl]-2-piperidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]morpholine
CID 46072118
4-[6-[(4-fluorophenyl)methyl]-4-(2-methylphenoxy)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]morpholine
CID 46072197
4-[6-[(2-fluoro-5-methylphenyl)methyl]-4-piperidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]morpholine
CID 42870515
4-[6-(furan-2-ylmethyl)-4-phenoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]morpholine
CID 42870646
(2-ethyl-7,9-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanamine
CID 82450935
4-[4-(3-methoxyphenoxy)-6-(thiophen-2-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]morpholine
CID 46072235
(2,6-diethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanamine
CID 82450203

Frequently Asked Questions

What is the IUPAC name of (6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride?
The IUPAC name of (6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride (CID 82022695) is (6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride.
What is the SMILES notation for (6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride?
The canonical SMILES for (6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride is CCN1CCc2nc(N3CCOCC3)nc(CN)c2C1.Cl.Cl.
What is the InChIKey of (6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride?
The InChIKey is WLJMWWGLUPCQGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O.2ClH/c1-2-18-4-3-12-11(10-18)13(9-15)17-14(16-12)19-5-7-20-8-6-19;;/h2-10,15H2,1H3;2*1H.
What are the key properties of (6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride?
(6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride has a molecular weight of 350.29 g/mol, XLogP of 0.99, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (6-ethyl-2-morpholin-4-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)methanamine;dihydrochloride is sourced from PubChem (CID 82022695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).