3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide

C19H25N5O2 — CID 127428554

IUPAC3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide
SMILESCC1CN(C(=O)Nc2ccn(-c3ccccc3)n2)CC1N1CCOCC1
InChIInChI=1S/C19H25N5O2/c1-15-13-23(14-17(15)22-9-11-26-12-10-22)19(25)20-18-7-8-24(21-18)16-5-3-2-4-6-16/h2-8,15,17H,9-14H2,1H3,(H,20,21,25)
InChIKeyJSAVIRKDKAKEID-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.06
Rot. Bonds3

About 3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide

3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide (PubChem CID 127428554) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is 3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide
PubChem CID127428554
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC Name3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide
SMILESCC1CN(C(=O)Nc2ccn(-c3ccccc3)n2)CC1N1CCOCC1
InChIInChI=1S/C19H25N5O2/c1-15-13-23(14-17(15)22-9-11-26-12-10-22)19(25)20-18-7-8-24(21-18)16-5-3-2-4-6-16/h2-8,15,17H,9-14H2,1H3,(H,20,21,25)
InChIKeyJSAVIRKDKAKEID-UHFFFAOYSA-N
XLogP2.06
TPSA62.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3R,4S)-3-methyl-4-morpholin-4-yl-N-(2-prop-2-ynoxyphenyl)pyrrolidine-1-carboxamide
CID 124620055
1-[(2R)-2-methylmorpholin-4-yl]-2-[(1-phenylpyrazol-3-yl)amino]ethanone
CID 95579451
N-[1-(3,4-dimethoxyphenyl)pyrazol-3-yl]-4-phenylpiperazine-1-carboxamide
CID 18799534
(3S)-4-[(3R,4R)-3-methyl-4-morpholin-4-ylpyrrolidin-1-yl]-4-oxo-3-phenylbutanenitrile
CID 97340968
(4-fluoronaphthalen-1-yl)-[(3S,4R)-3-methyl-4-morpholin-4-ylpyrrolidin-1-yl]methanone
CID 125140917
5-(dimethylsulfamoyl)-2-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)benzamide
CID 55536639
3-methyl-N-(1-phenylpyrazol-3-yl)butanamide
CID 110470740
[(1R,2R)-2-(2-fluorophenyl)cyclopropyl]-[(3R,4R)-3-methyl-4-morpholin-4-ylpyrrolidin-1-yl]methanone
CID 129462021
2-(4-aminophenyl)-1-(3-methyl-4-morpholin-4-ylpyrrolidin-1-yl)ethanone
CID 119899571
4-fluoro-3-morpholin-4-ylsulfonyl-N-(1-phenylpyrazol-3-yl)benzamide
CID 55537140
[(3S,4R)-3-methyl-4-morpholin-4-ylpyrrolidin-1-yl]-([1,2,4]triazolo[4,3-a]pyridin-6-yl)methanone
CID 96513290
(3R)-3-hydroxy-N-[1-[3-(trifluoromethyl)phenyl]pyrazol-3-yl]pyrrolidine-1-carboxamide
CID 99777369

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide?
The IUPAC name of 3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide (CID 127428554) is 3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for 3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for 3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide is CC1CN(C(=O)Nc2ccn(-c3ccccc3)n2)CC1N1CCOCC1.
What is the InChIKey of 3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide?
The InChIKey is JSAVIRKDKAKEID-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-15-13-23(14-17(15)22-9-11-26-12-10-22)19(25)20-18-7-8-24(21-18)16-5-3-2-4-6-16/h2-8,15,17H,9-14H2,1H3,(H,20,21,25).
What are the key properties of 3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide?
3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-morpholin-4-yl-N-(1-phenylpyrazol-3-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 127428554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).