3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine

C15H20N4O — CID 110132426

IUPAC3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine
SMILESCc1ccncc1CN1CCOCC1c1[nH]ncc1C
InChIInChI=1S/C15H20N4O/c1-11-3-4-16-8-13(11)9-19-5-6-20-10-14(19)15-12(2)7-17-18-15/h3-4,7-8,14H,5-6,9-10H2,1-2H3,(H,17,18)
InChIKeyVVDUVKVSGWBLDT-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.00
Rot. Bonds3

About 3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine

3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine (PubChem CID 110132426) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine.

Molecular Properties

Compound Name3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine
PubChem CID110132426
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine
SMILESCc1ccncc1CN1CCOCC1c1[nH]ncc1C
InChIInChI=1S/C15H20N4O/c1-11-3-4-16-8-13(11)9-19-5-6-20-10-14(19)15-12(2)7-17-18-15/h3-4,7-8,14H,5-6,9-10H2,1-2H3,(H,17,18)
InChIKeyVVDUVKVSGWBLDT-UHFFFAOYSA-N
XLogP2.00
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(4-{4-[3-(pyridin-2-yl)-1H-pyrazol-4-yl]-pyridin-2-yl}phenyl)-methyl]tetrahydro-2H-pyran-4-ylamine
CID 10201693
4-[[4-[4-(5-pyridin-2-yl-1H-pyrazol-4-yl)-2-pyridinyl]phenyl]methyl]morpholine;hydrochloride
CID 10274521
4-(4-(4-(3-(pyridin-2-yl)-1H-pyrazol-4-yl)pyridin-2-yl)benzyl)morpholine
CID 10274522
N-(4-(4-(3-(pyridin-2-yl)-1H-pyrazol-4-yl)pyridin-2-yl)benzyl)tetrahydro-2H-pyran-3-amine
CID 45487422
3-[4-[3-(4-Fluorophenyl)-1-methylpyrazol-4-yl]-2-pyridinyl]morpholine
CID 53357600
(3S)-3-[4-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]-2-pyridinyl]morpholin-4-ium
CID 78225546
2-methoxy-N-methyl-N-[[4-[4-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-2-pyridinyl]phenyl]methyl]ethanamine
CID 58612163
(3s)-3-{4-[3-(4-Fluorophenyl)-1-Methyl-1h-Pyrazol-4-Yl]pyridin-2-Yl}morpholine
CID 71710906
3-[[4-[1-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrrolidin-3-yl]piperidin-1-yl]methyl]pyridine
CID 45174738
N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-(4-morpholinyl)-2-(3-pyridinyl)acetamide
CID 45239557
N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-methoxy-N-(pyridin-2-ylmethyl)ethanamine
CID 46991461
2-[(3,5-Dimethylpyrazol-1-yl)methyl]-4-(pyridin-3-ylmethyl)morpholine
CID 53555237

Frequently Asked Questions

What is the IUPAC name of 3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine?
The IUPAC name of 3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine (CID 110132426) is 3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine.
What is the SMILES notation for 3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine?
The canonical SMILES for 3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine is Cc1ccncc1CN1CCOCC1c1[nH]ncc1C.
What is the InChIKey of 3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine?
The InChIKey is VVDUVKVSGWBLDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-11-3-4-16-8-13(11)9-19-5-6-20-10-14(19)15-12(2)7-17-18-15/h3-4,7-8,14H,5-6,9-10H2,1-2H3,(H,17,18).
What are the key properties of 3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine?
3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine has a molecular weight of 272.35 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methyl-1H-pyrazol-5-yl)-4-[(4-methyl-3-pyridinyl)methyl]morpholine is sourced from PubChem (CID 110132426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).