6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine

C16H23N5O — CID 119948640

IUPAC6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine
SMILESCc1nn(C)c(C)c1CNc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C16H23N5O/c1-12-15(13(2)20(3)19-12)11-17-14-4-5-16(18-10-14)21-6-8-22-9-7-21/h4-5,10,17H,6-9,11H2,1-3H3
InChIKeyZFUWXWFIQOKPEA-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.88
Rot. Bonds4

About 6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine

6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine (PubChem CID 119948640) has the molecular formula C16H23N5O and a molecular weight of 301.39 g/mol. Its IUPAC name is 6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine
PubChem CID119948640
Molecular FormulaC16H23N5O
Molecular Weight301.39 g/mol
Exact Mass301.19
IUPAC Name6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine
SMILESCc1nn(C)c(C)c1CNc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C16H23N5O/c1-12-15(13(2)20(3)19-12)11-17-14-4-5-16(18-10-14)21-6-8-22-9-7-21/h4-5,10,17H,6-9,11H2,1-3H3
InChIKeyZFUWXWFIQOKPEA-UHFFFAOYSA-N
XLogP1.88
TPSA55.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine?
The IUPAC name of 6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine (CID 119948640) is 6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine.
What is the SMILES notation for 6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine?
The canonical SMILES for 6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine is Cc1nn(C)c(C)c1CNc1ccc(N2CCOCC2)nc1.
What is the InChIKey of 6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine?
The InChIKey is ZFUWXWFIQOKPEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O/c1-12-15(13(2)20(3)19-12)11-17-14-4-5-16(18-10-14)21-6-8-22-9-7-21/h4-5,10,17H,6-9,11H2,1-3H3.
What are the key properties of 6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine?
6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine has a molecular weight of 301.39 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 119948640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).