7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine

C16H19N7O — CID 66556035

IUPAC7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine
SMILESCn1cc(-c2cc3nccnc3c(NC[C@@H]3CNCCO3)n2)cn1
InChIInChI=1S/C16H19N7O/c1-23-10-11(7-21-23)13-6-14-15(19-3-2-18-14)16(22-13)20-9-12-8-17-4-5-24-12/h2-3,6-7,10,12,17H,4-5,8-9H2,1H3,(H,20,22)/t12-/m0/s1
InChIKeyUAUJVWLUSNTVTA-LBPRGKRZSA-N
MW325.38 g/mol
LogP0.83
Rot. Bonds4

About 7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine

7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine (PubChem CID 66556035) has the molecular formula C16H19N7O and a molecular weight of 325.38 g/mol. Its IUPAC name is 7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine.

Molecular Properties

Compound Name7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine
PubChem CID66556035
Molecular FormulaC16H19N7O
Molecular Weight325.38 g/mol
Exact Mass325.17
IUPAC Name7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine
SMILESCn1cc(-c2cc3nccnc3c(NC[C@@H]3CNCCO3)n2)cn1
InChIInChI=1S/C16H19N7O/c1-23-10-11(7-21-23)13-6-14-15(19-3-2-18-14)16(22-13)20-9-12-8-17-4-5-24-12/h2-3,6-7,10,12,17H,4-5,8-9H2,1H3,(H,20,22)/t12-/m0/s1
InChIKeyUAUJVWLUSNTVTA-LBPRGKRZSA-N
XLogP0.83
TPSA89.78 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.38
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine 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 7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine?
The IUPAC name of 7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine (CID 66556035) is 7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine.
What is the SMILES notation for 7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine?
The canonical SMILES for 7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine is Cn1cc(-c2cc3nccnc3c(NC[C@@H]3CNCCO3)n2)cn1.
What is the InChIKey of 7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine?
The InChIKey is UAUJVWLUSNTVTA-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H19N7O/c1-23-10-11(7-21-23)13-6-14-15(19-3-2-18-14)16(22-13)20-9-12-8-17-4-5-24-12/h2-3,6-7,10,12,17H,4-5,8-9H2,1H3,(H,20,22)/t12-/m0/s1.
What are the key properties of 7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine?
7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine has a molecular weight of 325.38 g/mol, XLogP of 0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1-methylpyrazol-4-yl)-N-[[(2S)-morpholin-2-yl]methyl]pyrido[3,4-b]pyrazin-5-amine is sourced from PubChem (CID 66556035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).