1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide

C16H26N4O3 — CID 94021723

IUPAC1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide
SMILESCc1c(C(=O)NC[C@@H]([C@H]2CCOC2)N2CCOCC2)cnn1C
InChIInChI=1S/C16H26N4O3/c1-12-14(9-18-19(12)2)16(21)17-10-15(13-3-6-23-11-13)20-4-7-22-8-5-20/h9,13,15H,3-8,10-11H2,1-2H3,(H,17,21)/t13-,15-/m0/s1
InChIKeyBQAPPMPZAQYJIW-ZFWWWQNUSA-N
MW322.41 g/mol
LogP0.20
Rot. Bonds5

About 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide

1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide (PubChem CID 94021723) has the molecular formula C16H26N4O3 and a molecular weight of 322.41 g/mol. Its IUPAC name is 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide
PubChem CID94021723
Molecular FormulaC16H26N4O3
Molecular Weight322.41 g/mol
Exact Mass322.20
IUPAC Name1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide
SMILESCc1c(C(=O)NC[C@@H]([C@H]2CCOC2)N2CCOCC2)cnn1C
InChIInChI=1S/C16H26N4O3/c1-12-14(9-18-19(12)2)16(21)17-10-15(13-3-6-23-11-13)20-4-7-22-8-5-20/h9,13,15H,3-8,10-11H2,1-2H3,(H,17,21)/t13-,15-/m0/s1
InChIKeyBQAPPMPZAQYJIW-ZFWWWQNUSA-N
XLogP0.20
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide with MolForge

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Related Compounds

1,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide
CID 94021725
2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide
CID 94083341
5-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-1,2-oxazole-3-carboxamide
CID 94022952
2-(4-methylphenyl)-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]acetamide
CID 94150138
1-methyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 94021718
2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide
CID 55642293
2-methoxy-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]pyridine-3-carboxamide
CID 94024269
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]pyrrole-3-carboxamide
CID 55642248
6-cyclopropyl-3-methyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 78858824
N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
CID 52582079
N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]thiophene-2-carboxamide
CID 94083431
5-ethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-2-carboxamide
CID 94021730

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide?
The IUPAC name of 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide (CID 94021723) is 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide.
What is the SMILES notation for 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide?
The canonical SMILES for 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide is Cc1c(C(=O)NC[C@@H]([C@H]2CCOC2)N2CCOCC2)cnn1C.
What is the InChIKey of 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide?
The InChIKey is BQAPPMPZAQYJIW-ZFWWWQNUSA-N. The full InChI is InChI=1S/C16H26N4O3/c1-12-14(9-18-19(12)2)16(21)17-10-15(13-3-6-23-11-13)20-4-7-22-8-5-20/h9,13,15H,3-8,10-11H2,1-2H3,(H,17,21)/t13-,15-/m0/s1.
What are the key properties of 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide?
1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide has a molecular weight of 322.41 g/mol, XLogP of 0.20, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide is sourced from PubChem (CID 94021723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).