2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine

C17H24N4O — CID 127245697

IUPAC2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine
SMILESCCCn1cc(CN2CCOC(c3ccc(C)cn3)C2)cn1
InChIInChI=1S/C17H24N4O/c1-3-6-21-12-15(10-19-21)11-20-7-8-22-17(13-20)16-5-4-14(2)9-18-16/h4-5,9-10,12,17H,3,6-8,11,13H2,1-2H3
InChIKeyJDLKSPGZJYDLHA-UHFFFAOYSA-N
MW300.41 g/mol
LogP2.57
Rot. Bonds5

About 2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine

2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine (PubChem CID 127245697) has the molecular formula C17H24N4O and a molecular weight of 300.41 g/mol. Its IUPAC name is 2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine.

Molecular Properties

Compound Name2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine
PubChem CID127245697
Molecular FormulaC17H24N4O
Molecular Weight300.41 g/mol
Exact Mass300.20
IUPAC Name2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine
SMILESCCCn1cc(CN2CCOC(c3ccc(C)cn3)C2)cn1
InChIInChI=1S/C17H24N4O/c1-3-6-21-12-15(10-19-21)11-20-7-8-22-17(13-20)16-5-4-14(2)9-18-16/h4-5,9-10,12,17H,3,6-8,11,13H2,1-2H3
InChIKeyJDLKSPGZJYDLHA-UHFFFAOYSA-N
XLogP2.57
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.41
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-4-[(1-propylpyrazol-4-yl)methyl]-2-pyridin-2-ylmorpholine
CID 124941629
N-methyl-3-[4-[(1-propylpyrazol-4-yl)methyl]morpholin-2-yl]pyrazin-2-amine
CID 110113016
4-[(1-ethylpyrazol-4-yl)methyl]-2-phenylmorpholine
CID 75438520
2-[4-[(1-propylpyrazol-4-yl)methyl]morpholin-2-yl]acetic acid
CID 103573426
(2R)-2-(6-benzyl-2-pyridinyl)-4-[(1-ethylpyrazol-4-yl)methyl]morpholine
CID 124974858
(2S)-2-(5-methyl-2-pyridinyl)-4-(quinolin-2-ylmethyl)morpholine
CID 124998096
6-[(2S)-4-[(1-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-3-amine
CID 124958285
(2S)-4-[(1-ethylpyrazol-4-yl)methyl]-2-[6-(4-methoxyphenyl)-2-pyridinyl]morpholine
CID 124977152
2-methyl-4-[1-[(1-propylpyrazol-4-yl)methyl]piperidin-3-yl]pyrimidine
CID 110115044
3-methyl-1-[(1-propylpyrazol-4-yl)methyl]piperazine
CID 115879784
N,N-dimethyl-2-[2-(5-methyl-2-pyridinyl)morpholin-4-yl]acetamide
CID 110270826
(2S)-2-[6-[(3-chlorophenyl)methyl]-2-pyridinyl]-4-[(1-ethylpyrazol-4-yl)methyl]morpholine
CID 125020601

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine?
The IUPAC name of 2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine (CID 127245697) is 2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine.
What is the SMILES notation for 2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine?
The canonical SMILES for 2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine is CCCn1cc(CN2CCOC(c3ccc(C)cn3)C2)cn1.
What is the InChIKey of 2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine?
The InChIKey is JDLKSPGZJYDLHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O/c1-3-6-21-12-15(10-19-21)11-20-7-8-22-17(13-20)16-5-4-14(2)9-18-16/h4-5,9-10,12,17H,3,6-8,11,13H2,1-2H3.
What are the key properties of 2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine?
2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine has a molecular weight of 300.41 g/mol, XLogP of 2.57, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-2-pyridinyl)-4-[(1-propylpyrazol-4-yl)methyl]morpholine is sourced from PubChem (CID 127245697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).