N-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide

C19H24N4O4 — CID 178043641

IUPACN-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide
SMILESCN(CCOc1ccccc1)C(=O)Cn1cc(NC(=O)C2CCCO2)cn1
InChIInChI=1S/C19H24N4O4/c1-22(9-11-26-16-6-3-2-4-7-16)18(24)14-23-13-15(12-20-23)21-19(25)17-8-5-10-27-17/h2-4,6-7,12-13,17H,5,8-11,14H2,1H3,(H,21,25)
InChIKeyPOMMVRQZYBPGGA-UHFFFAOYSA-N
MW372.43 g/mol
LogP1.54
Rot. Bonds8

About N-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide

N-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide (PubChem CID 178043641) has the molecular formula C19H24N4O4 and a molecular weight of 372.43 g/mol. Its IUPAC name is N-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide
PubChem CID178043641
Molecular FormulaC19H24N4O4
Molecular Weight372.43 g/mol
Exact Mass372.18
IUPAC NameN-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide
SMILESCN(CCOc1ccccc1)C(=O)Cn1cc(NC(=O)C2CCCO2)cn1
InChIInChI=1S/C19H24N4O4/c1-22(9-11-26-16-6-3-2-4-7-16)18(24)14-23-13-15(12-20-23)21-19(25)17-8-5-10-27-17/h2-4,6-7,12-13,17H,5,8-11,14H2,1H3,(H,21,25)
InChIKeyPOMMVRQZYBPGGA-UHFFFAOYSA-N
XLogP1.54
TPSA85.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-[2-[2-(2,4-dichlorophenoxy)ethyl-methylamino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide
CID 178043685
ethane;4-methyl-N-[1-[2-[methyl-[2-(4-methylphenoxy)ethyl]amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide
CID 178043698
4-[benzyl(methyl)amino]-N-[1-[2-[methyl-[2-(4-methylphenoxy)ethyl]amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide
CID 178043622
methyl 2-[4-[[(2S)-oxolane-2-carbonyl]amino]pyrazol-1-yl]acetate
CID 93440590
(2S)-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]oxolane-2-carboxamide
CID 35277538
N-[1-[2-[methyl-[2-(4-methylphenoxy)ethyl]amino]-2-oxoethyl]pyrazol-4-yl]-3-(pyridin-4-ylamino)cyclobutane-1-carboxamide
CID 171654882
N-(3-phenoxypropyl)oxolane-2-carboxamide
CID 74588309
piperidin-3-yl N-[1-[2-[methyl-[2-(4-methylphenoxy)ethyl]amino]-2-oxoethyl]pyrazol-4-yl]carbamate
CID 171654658
N-[1-[2-[methyl-[2-(4-methylphenoxy)ethyl]amino]-2-oxoethyl]pyrazol-4-yl]-4-propan-2-yl-1,3-benzodioxole-2-carboxamide
CID 171654777
3-(2-fluorophenoxy)-N-[1-[2-[methyl-[2-(4-methylphenoxy)ethyl]amino]-2-oxoethyl]pyrazol-4-yl]propanamide
CID 166148005
6-methoxy-N-[1-[2-[methyl-[2-(4-methylphenoxy)ethyl]amino]-2-oxoethyl]pyrazol-4-yl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 171654739
N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]oxolane-2-carboxamide
CID 71993905

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide?
The IUPAC name of N-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide (CID 178043641) is N-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide.
What is the SMILES notation for N-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide?
The canonical SMILES for N-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide is CN(CCOc1ccccc1)C(=O)Cn1cc(NC(=O)C2CCCO2)cn1.
What is the InChIKey of N-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide?
The InChIKey is POMMVRQZYBPGGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O4/c1-22(9-11-26-16-6-3-2-4-7-16)18(24)14-23-13-15(12-20-23)21-19(25)17-8-5-10-27-17/h2-4,6-7,12-13,17H,5,8-11,14H2,1H3,(H,21,25).
What are the key properties of N-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide?
N-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide has a molecular weight of 372.43 g/mol, XLogP of 1.54, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-[methyl(2-phenoxyethyl)amino]-2-oxoethyl]pyrazol-4-yl]oxolane-2-carboxamide is sourced from PubChem (CID 178043641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).