5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide

C21H24N4O3 — CID 97189860

IUPAC5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide
SMILESO=C(N[C@@H](Cn1cccn1)c1ccccc1)c1coc(CN2CCOCC2)c1
InChIInChI=1S/C21H24N4O3/c26-21(18-13-19(28-16-18)14-24-9-11-27-12-10-24)23-20(15-25-8-4-7-22-25)17-5-2-1-3-6-17/h1-8,13,16,20H,9-12,14-15H2,(H,23,26)/t20-/m0/s1
InChIKeyPSPCSBRPMPRFLK-FQEVSTJZSA-N
MW380.45 g/mol
LogP2.48
Rot. Bonds7

About 5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide

5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide (PubChem CID 97189860) has the molecular formula C21H24N4O3 and a molecular weight of 380.45 g/mol. Its IUPAC name is 5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide.

Molecular Properties

Compound Name5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide
PubChem CID97189860
Molecular FormulaC21H24N4O3
Molecular Weight380.45 g/mol
Exact Mass380.18
IUPAC Name5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide
SMILESO=C(N[C@@H](Cn1cccn1)c1ccccc1)c1coc(CN2CCOCC2)c1
InChIInChI=1S/C21H24N4O3/c26-21(18-13-19(28-16-18)14-24-9-11-27-12-10-24)23-20(15-25-8-4-7-22-25)17-5-2-1-3-6-17/h1-8,13,16,20H,9-12,14-15H2,(H,23,26)/t20-/m0/s1
InChIKeyPSPCSBRPMPRFLK-FQEVSTJZSA-N
XLogP2.48
TPSA72.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.45
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(1S)-2-(methylamino)-2-oxo-1-phenylethyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
CID 125172950
5-bromo-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]pyridine-3-carboxamide
CID 9148597
3,5-dimethyl-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]benzamide
CID 25485403
N-[(1S)-1-phenyl-2-pyrrolidin-1-ylethyl]-3-(pyrazol-1-ylmethyl)benzamide
CID 97137368
N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
CID 118788788
5-(morpholin-4-ylmethyl)-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]furan-3-carboxamide
CID 97188780
N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-3-(1,2,4-triazol-4-yl)benzamide
CID 95135581
N-(1-phenyl-2-pyrazol-1-ylethyl)-3-(1,2,4-triazol-4-yl)benzamide
CID 50973724
3-oxo-N-[(1S)-1-phenyl-2-pyrazol-1-ylethyl]-2,4-dihydro-1H-quinoxaline-6-carboxamide
CID 99947261
4-bromo-3,5-dimethoxy-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide
CID 25485450
[(1S)-2-morpholin-4-yl-1-phenylethyl]carbamic acid
CID 68931667
3-(2-methylpropyl)-N-(1-phenyl-2-pyrazol-1-ylethyl)-1,2-oxazole-5-carboxamide
CID 70770272

Frequently Asked Questions

What is the IUPAC name of 5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide?
The IUPAC name of 5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide (CID 97189860) is 5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide.
What is the SMILES notation for 5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide?
The canonical SMILES for 5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide is O=C(N[C@@H](Cn1cccn1)c1ccccc1)c1coc(CN2CCOCC2)c1.
What is the InChIKey of 5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide?
The InChIKey is PSPCSBRPMPRFLK-FQEVSTJZSA-N. The full InChI is InChI=1S/C21H24N4O3/c26-21(18-13-19(28-16-18)14-24-9-11-27-12-10-24)23-20(15-25-8-4-7-22-25)17-5-2-1-3-6-17/h1-8,13,16,20H,9-12,14-15H2,(H,23,26)/t20-/m0/s1.
What are the key properties of 5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide?
5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide has a molecular weight of 380.45 g/mol, XLogP of 2.48, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide is sourced from PubChem (CID 97189860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).