6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine

C19H22N6O — CID 124958285

IUPAC6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine
SMILESCn1cc(CN2CCO[C@H](c3ccc(Nc4ccccn4)cn3)C2)cn1
InChIInChI=1S/C19H22N6O/c1-24-12-15(10-22-24)13-25-8-9-26-18(14-25)17-6-5-16(11-21-17)23-19-4-2-3-7-20-19/h2-7,10-12,18H,8-9,13-14H2,1H3,(H,20,23)/t18-/m0/s1
InChIKeyGEZFUMPGMPURCD-SFHVURJKSA-N
MW350.43 g/mol
LogP2.53
Rot. Bonds5

About 6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine

6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine (PubChem CID 124958285) has the molecular formula C19H22N6O and a molecular weight of 350.43 g/mol. Its IUPAC name is 6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine.

Molecular Properties

Compound Name6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine
PubChem CID124958285
Molecular FormulaC19H22N6O
Molecular Weight350.43 g/mol
Exact Mass350.19
IUPAC Name6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine
SMILESCn1cc(CN2CCO[C@H](c3ccc(Nc4ccccn4)cn3)C2)cn1
InChIInChI=1S/C19H22N6O/c1-24-12-15(10-22-24)13-25-8-9-26-18(14-25)17-6-5-16(11-21-17)23-19-4-2-3-7-20-19/h2-7,10-12,18H,8-9,13-14H2,1H3,(H,20,23)/t18-/m0/s1
InChIKeyGEZFUMPGMPURCD-SFHVURJKSA-N
XLogP2.53
TPSA68.10 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.43
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine?
The IUPAC name of 6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine (CID 124958285) is 6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine.
What is the SMILES notation for 6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine?
The canonical SMILES for 6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine is Cn1cc(CN2CCO[C@H](c3ccc(Nc4ccccn4)cn3)C2)cn1.
What is the InChIKey of 6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine?
The InChIKey is GEZFUMPGMPURCD-SFHVURJKSA-N. The full InChI is InChI=1S/C19H22N6O/c1-24-12-15(10-22-24)13-25-8-9-26-18(14-25)17-6-5-16(11-21-17)23-19-4-2-3-7-20-19/h2-7,10-12,18H,8-9,13-14H2,1H3,(H,20,23)/t18-/m0/s1.
What are the key properties of 6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine?
6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine has a molecular weight of 350.43 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine is sourced from PubChem (CID 124958285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).