[4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine

C18H21N5O — CID 67435921

IUPAC[4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine
SMILESCc1ccc(-n2nc(N3CCOC(CN)C3)c3ccncc32)cc1
InChIInChI=1S/C18H21N5O/c1-13-2-4-14(5-3-13)23-17-11-20-7-6-16(17)18(21-23)22-8-9-24-15(10-19)12-22/h2-7,11,15H,8-10,12,19H2,1H3
InChIKeyVYEUNAHSJPIMJT-UHFFFAOYSA-N
MW323.40 g/mol
LogP1.89
Rot. Bonds3

About [4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine

[4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine (PubChem CID 67435921) has the molecular formula C18H21N5O and a molecular weight of 323.40 g/mol. Its IUPAC name is [4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine
PubChem CID67435921
Molecular FormulaC18H21N5O
Molecular Weight323.40 g/mol
Exact Mass323.17
IUPAC Name[4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine
SMILESCc1ccc(-n2nc(N3CCOC(CN)C3)c3ccncc32)cc1
InChIInChI=1S/C18H21N5O/c1-13-2-4-14(5-3-13)23-17-11-20-7-6-16(17)18(21-23)22-8-9-24-15(10-19)12-22/h2-7,11,15H,8-10,12,19H2,1H3
InChIKeyVYEUNAHSJPIMJT-UHFFFAOYSA-N
XLogP1.89
TPSA69.20 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine?
The IUPAC name of [4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine (CID 67435921) is [4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine.
What is the SMILES notation for [4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine?
The canonical SMILES for [4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine is Cc1ccc(-n2nc(N3CCOC(CN)C3)c3ccncc32)cc1.
What is the InChIKey of [4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine?
The InChIKey is VYEUNAHSJPIMJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O/c1-13-2-4-14(5-3-13)23-17-11-20-7-6-16(17)18(21-23)22-8-9-24-15(10-19)12-22/h2-7,11,15H,8-10,12,19H2,1H3.
What are the key properties of [4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine?
[4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine has a molecular weight of 323.40 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanamine is sourced from PubChem (CID 67435921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).