(5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone

C14H21N3O2 — CID 74233588

IUPAC(5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone
SMILESO=C(c1cn[nH]c1C1CCCCC1)N1CCOCC1
InChIInChI=1S/C14H21N3O2/c18-14(17-6-8-19-9-7-17)12-10-15-16-13(12)11-4-2-1-3-5-11/h10-11H,1-9H2,(H,15,16)
InChIKeyWRWAIYIPOGFUQX-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.93
Rot. Bonds2

About (5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone

(5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone (PubChem CID 74233588) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is (5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone
PubChem CID74233588
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name(5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone
SMILESO=C(c1cn[nH]c1C1CCCCC1)N1CCOCC1
InChIInChI=1S/C14H21N3O2/c18-14(17-6-8-19-9-7-17)12-10-15-16-13(12)11-4-2-1-3-5-11/h10-11H,1-9H2,(H,15,16)
InChIKeyWRWAIYIPOGFUQX-UHFFFAOYSA-N
XLogP1.93
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-morpholin-4-ylethyl)-5-phenyl-1H-pyrazole-4-carboxamide
CID 162658317
7-[(3-cyclohexyl-1H-pyrazol-4-yl)carbonyl]-1-oxa-3,7-diazaspiro[4.5]decan-2-one
CID 56888097
3-cyclohexyl-N-[(3S*,4S*)-4-ethoxy-1-methyl-3-pyrrolidinyl]-1H-pyrazole-4-carboxamide
CID 70752265
3-cyclohexyl-N-[(3S*,4R*)-4-ethoxytetrahydro-3-furanyl]-1H-pyrazole-4-carboxamide
CID 70760698
3-cyclohexyl-N-[(3R*,4R*)-4-(1-pyrrolidinyl)tetrahydro-3-furanyl]-1H-pyrazole-4-carboxamide
CID 70765557
N-(2-methoxyethyl)-3-(piperidin-3-yl)-1H-pyrazole-4-carboxamide
CID 86812391
morpholin-4-yl-(5-phenyl-1H-pyrazol-4-yl)methanone
CID 45800953
8-[(3-propyl-1H-pyrazol-4-yl)carbonyl]-1-oxa-8-azaspiro[4.5]decane
CID 56868207
N,N-dimethyl-5-piperidin-3-yl-1H-pyrazole-4-carboxamide
CID 86812282
N-(2,2-dimethylpropyl)-N-methyl-5-propyl-1H-pyrazole-4-carboxamide
CID 91648947
3-(piperidin-3-yl)-1H-pyrazole-4-carboxamide
CID 91662771
4-[3-(Piperidin-3-yl)-1H-pyrazole-4-carbonyl]morpholine
CID 121692798

Frequently Asked Questions

What is the IUPAC name of (5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone?
The IUPAC name of (5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone (CID 74233588) is (5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone is O=C(c1cn[nH]c1C1CCCCC1)N1CCOCC1.
What is the InChIKey of (5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone?
The InChIKey is WRWAIYIPOGFUQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c18-14(17-6-8-19-9-7-17)12-10-15-16-13(12)11-4-2-1-3-5-11/h10-11H,1-9H2,(H,15,16).
What are the key properties of (5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone?
(5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone has a molecular weight of 263.34 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclohexyl-1H-pyrazol-4-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 74233588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).