[3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone

C19H18ClN3O2 — CID 118879442

IUPAC[3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone
SMILESCc1[nH]nc2ccc(C(=O)N3CCOCC3c3ccc(Cl)cc3)cc12
InChIInChI=1S/C19H18ClN3O2/c1-12-16-10-14(4-7-17(16)22-21-12)19(24)23-8-9-25-11-18(23)13-2-5-15(20)6-3-13/h2-7,10,18H,8-9,11H2,1H3,(H,21,22)
InChIKeyVZPGERSMGVRRCU-UHFFFAOYSA-N
MW355.83 g/mol
LogP3.74
Rot. Bonds2

About [3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone

[3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone (PubChem CID 118879442) has the molecular formula C19H18ClN3O2 and a molecular weight of 355.83 g/mol. Its IUPAC name is [3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone.

Molecular Properties

Compound Name[3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone
PubChem CID118879442
Molecular FormulaC19H18ClN3O2
Molecular Weight355.83 g/mol
Exact Mass355.11
IUPAC Name[3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone
SMILESCc1[nH]nc2ccc(C(=O)N3CCOCC3c3ccc(Cl)cc3)cc12
InChIInChI=1S/C19H18ClN3O2/c1-12-16-10-14(4-7-17(16)22-21-12)19(24)23-8-9-25-11-18(23)13-2-5-15(20)6-3-13/h2-7,10,18H,8-9,11H2,1H3,(H,21,22)
InChIKeyVZPGERSMGVRRCU-UHFFFAOYSA-N
XLogP3.74
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.83
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(2S)-2-(4-chlorophenyl)pyrrolidin-1-yl]-(3-methyl-2H-indazol-5-yl)methanone
CID 91827689
3-[6-(2-Chloro-phenylamino)-1H-indazol-3-yl]-N-(3-morpholin-4-yl-propyl)-benzamide
CID 10152189
N-[cyclopropyl(phenyl)methyl]-3-(4-morpholin-4-ylphenyl)-1H-indazole-5-carboxamide
CID 89509657
N-[(1S)-1-(2-chlorophenyl)-2-methylpropyl]-3-[4-(3-oxa-8-azabicyclo[3.2.1]octan-8-yl)phenyl]-1H-indazole-5-carboxamide
CID 117751334
[2-(4-chlorophenyl)-4-methylpiperazin-1-yl]-(3-methyl-2H-indazol-5-yl)methanone
CID 118879399
[(2S)-2-(4-chlorophenyl)azetidin-1-yl]-(3-methyl-2H-indazol-5-yl)methanone
CID 130423545
(4-chlorophenyl){1-[(5-methyl-1H-indazol-3-yl)carbonyl]piperidin-3-yl}methanone
CID 16188605
N-[1-(3-chlorophenyl)-2-hydroxyethyl]-3-phenyl-1H-indazole-5-carboxamide
CID 127047025
N-[1-(3-chlorophenyl)-2-hydroxyethyl]-3-(oxan-4-yl)-2H-indazole-5-carboxamide
CID 127047026
[(2S)-2-(4-chlorophenyl)pyrrolidin-1-yl]-(1H-indazol-5-yl)methanone
CID 134141248
{3-(4-Fluorophenyl)(1h-indazol-5-yl)}-n-(3-morpholin-4-ylpropyl)carboxamide
CID 9999949
ethyl 1-[3-(4-fluorophenyl)-1H-indazole-5-carbonyl]piperidine-4-carboxylate
CID 20789086

Frequently Asked Questions

What is the IUPAC name of [3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone?
The IUPAC name of [3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone (CID 118879442) is [3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone.
What is the SMILES notation for [3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone?
The canonical SMILES for [3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone is Cc1[nH]nc2ccc(C(=O)N3CCOCC3c3ccc(Cl)cc3)cc12.
What is the InChIKey of [3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone?
The InChIKey is VZPGERSMGVRRCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3O2/c1-12-16-10-14(4-7-17(16)22-21-12)19(24)23-8-9-25-11-18(23)13-2-5-15(20)6-3-13/h2-7,10,18H,8-9,11H2,1H3,(H,21,22).
What are the key properties of [3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone?
[3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone has a molecular weight of 355.83 g/mol, XLogP of 3.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-chlorophenyl)morpholin-4-yl]-(3-methyl-2H-indazol-5-yl)methanone is sourced from PubChem (CID 118879442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).