morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone

C19H25N5O2 — CID 95840395

IUPACmorpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone
SMILESO=C(c1cc([C@H]2CCCCN2Cc2cccnc2)[nH]n1)N1CCOCC1
InChIInChI=1S/C19H25N5O2/c25-19(23-8-10-26-11-9-23)17-12-16(21-22-17)18-5-1-2-7-24(18)14-15-4-3-6-20-13-15/h3-4,6,12-13,18H,1-2,5,7-11,14H2,(H,21,22)/t18-/m1/s1
InChIKeyCOUIXUYZTWVOPV-GOSISDBHSA-N
MW355.44 g/mol
LogP2.00
Rot. Bonds4

About morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone

morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone (PubChem CID 95840395) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone
PubChem CID95840395
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC Namemorpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone
SMILESO=C(c1cc([C@H]2CCCCN2Cc2cccnc2)[nH]n1)N1CCOCC1
InChIInChI=1S/C19H25N5O2/c25-19(23-8-10-26-11-9-23)17-12-16(21-22-17)18-5-1-2-7-24(18)14-15-4-3-6-20-13-15/h3-4,6,12-13,18H,1-2,5,7-11,14H2,(H,21,22)/t18-/m1/s1
InChIKeyCOUIXUYZTWVOPV-GOSISDBHSA-N
XLogP2.00
TPSA74.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[5-[(2S)-1-[(4-fluorophenyl)methyl]piperidin-2-yl]-1H-pyrazol-3-yl]-morpholin-4-ylmethanone
CID 95840424
morpholin-4-yl-[5-[(2S)-1-(3-phenylpropyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone
CID 95840524
1-[(2S)-2-[3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]piperidin-1-yl]-3-phenylpropan-1-one
CID 95840546
1-[2-[3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]piperidin-1-yl]ethanone
CID 110268834
[2-[3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 110268862
3-(4-fluorophenyl)-1-[2-[3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]piperidin-1-yl]propan-1-one
CID 110268966
morpholin-4-yl-[3-[[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]methyl]-1-benzothiophen-2-yl]methanone
CID 95839959
5-(1-benzylpiperidin-2-yl)-N-cyclopentyl-1H-pyrazole-3-carboxamide
CID 110268851
2-(4-fluorophenoxy)-1-[(2R)-2-[3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]piperidin-1-yl]ethanone
CID 95840607
morpholin-4-yl-(5-piperidin-2-yl-1H-pyrazol-3-yl)methanone
CID 110085527
5-methyl-3-[1-(pyridin-3-ylmethyl)azepan-2-yl]-1,2-oxazole
CID 110225930
1-[3-[3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]piperidin-1-yl]-2-pyrrolidin-1-ylethanone
CID 110268882

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone?
The IUPAC name of morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone (CID 95840395) is morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone?
The canonical SMILES for morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone is O=C(c1cc([C@H]2CCCCN2Cc2cccnc2)[nH]n1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone?
The InChIKey is COUIXUYZTWVOPV-GOSISDBHSA-N. The full InChI is InChI=1S/C19H25N5O2/c25-19(23-8-10-26-11-9-23)17-12-16(21-22-17)18-5-1-2-7-24(18)14-15-4-3-6-20-13-15/h3-4,6,12-13,18H,1-2,5,7-11,14H2,(H,21,22)/t18-/m1/s1.
What are the key properties of morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone?
morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone has a molecular weight of 355.44 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[5-[(2R)-1-(pyridin-3-ylmethyl)piperidin-2-yl]-1H-pyrazol-3-yl]methanone is sourced from PubChem (CID 95840395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).