(2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone

C15H18N4O2 — CID 154797843

IUPAC(2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone
SMILESCCC1CN(C(=O)c2cnn(-c3ccncc3)c2)CCO1
InChIInChI=1S/C15H18N4O2/c1-2-14-11-18(7-8-21-14)15(20)12-9-17-19(10-12)13-3-5-16-6-4-13/h3-6,9-10,14H,2,7-8,11H2,1H3
InChIKeyQHTGSPQVOXGHEE-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.52
Rot. Bonds3

About (2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone

(2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone (PubChem CID 154797843) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is (2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone.

Molecular Properties

Compound Name(2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone
PubChem CID154797843
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC Name(2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone
SMILESCCC1CN(C(=O)c2cnn(-c3ccncc3)c2)CCO1
InChIInChI=1S/C15H18N4O2/c1-2-14-11-18(7-8-21-14)15(20)12-9-17-19(10-12)13-3-5-16-6-4-13/h3-6,9-10,14H,2,7-8,11H2,1H3
InChIKeyQHTGSPQVOXGHEE-UHFFFAOYSA-N
XLogP1.52
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2R)-4-[1-(4-chlorophenyl)pyrazole-4-carbonyl]morpholin-2-yl]acetic acid
CID 124705038
(2R)-2-ethyl-N-[(1-phenylpyrazol-4-yl)methyl]morpholine-4-carboxamide
CID 95280201
(2-ethylmorpholin-4-yl)-(4-sulfanylphenyl)methanone
CID 107023047
2-[4-(1-ethylpyrazole-4-carbonyl)morpholin-2-yl]acetic acid
CID 119248465
3-(2-ethylmorpholine-4-carbonyl)benzoic acid
CID 43563067
(2R)-4-[4-(4-methylpyrazol-1-yl)benzoyl]morpholine-2-carboxylic acid
CID 129415319
(2-ethylmorpholin-4-yl)-[4-(propylamino)-3-pyridinyl]methanone
CID 81242863
(2-ethylmorpholin-4-yl)-(4-methylsulfonylphenyl)methanone
CID 43070670
[1-(2-methoxyphenyl)pyrazol-4-yl]-[(2S)-2-(pyrazol-1-ylmethyl)-1,4-oxazepan-4-yl]methanone
CID 97153764
4-[1-(4-nitrophenyl)pyrazole-4-carbonyl]morpholine-2-carboxylic acid
CID 119240073
(4-bromo-3-methylphenyl)-(2-ethylmorpholin-4-yl)methanone
CID 112705730
1,3-benzodioxol-5-yl-(2-ethylmorpholin-4-yl)methanone
CID 43070650

Frequently Asked Questions

What is the IUPAC name of (2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone?
The IUPAC name of (2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone (CID 154797843) is (2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone.
What is the SMILES notation for (2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone?
The canonical SMILES for (2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone is CCC1CN(C(=O)c2cnn(-c3ccncc3)c2)CCO1.
What is the InChIKey of (2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone?
The InChIKey is QHTGSPQVOXGHEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-2-14-11-18(7-8-21-14)15(20)12-9-17-19(10-12)13-3-5-16-6-4-13/h3-6,9-10,14H,2,7-8,11H2,1H3.
What are the key properties of (2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone?
(2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone has a molecular weight of 286.33 g/mol, XLogP of 1.52, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylmorpholin-4-yl)-(1-pyridin-4-ylpyrazol-4-yl)methanone is sourced from PubChem (CID 154797843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).