(6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide

C23H25N3O3 — CID 125127257

IUPAC(6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide
SMILESCC[C@H](NC(=O)c1ncn2c1CO[C@H](c1ccccc1)C2)c1ccc(OC)cc1
InChIInChI=1S/C23H25N3O3/c1-3-19(16-9-11-18(28-2)12-10-16)25-23(27)22-20-14-29-21(13-26(20)15-24-22)17-7-5-4-6-8-17/h4-12,15,19,21H,3,13-14H2,1-2H3,(H,25,27)/t19-,21-/m0/s1
InChIKeyLVZOBPIRIHJLCD-FPOVZHCZSA-N
MW391.47 g/mol
LogP4.04
Rot. Bonds6

About (6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide

(6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide (PubChem CID 125127257) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is (6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide.

Molecular Properties

Compound Name(6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide
PubChem CID125127257
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC Name(6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide
SMILESCC[C@H](NC(=O)c1ncn2c1CO[C@H](c1ccccc1)C2)c1ccc(OC)cc1
InChIInChI=1S/C23H25N3O3/c1-3-19(16-9-11-18(28-2)12-10-16)25-23(27)22-20-14-29-21(13-26(20)15-24-22)17-7-5-4-6-8-17/h4-12,15,19,21H,3,13-14H2,1-2H3,(H,25,27)/t19-,21-/m0/s1
InChIKeyLVZOBPIRIHJLCD-FPOVZHCZSA-N
XLogP4.04
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(6S)-6-(4-methoxyphenyl)-N-[(2S)-2-phenylpropyl]-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide
CID 125126799
(6R)-N-[(2-bromophenyl)methyl]-6-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide
CID 125125789
(6R)-N-[(3-ethoxyphenyl)methyl]-6-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide
CID 125127981
(4-benzylpiperidin-1-yl)-[6-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazin-1-yl]methanone
CID 91894330
[6-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazin-1-yl]-piperidin-1-ylmethanone
CID 91894328
[(3R,5R)-3,5-dimethylpiperidin-1-yl]-[(6R)-6-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazin-1-yl]methanone
CID 125126558
(6R)-N-(4-methoxyphenyl)-6-phenyl-6,7-dihydro-4H-triazolo[5,1-c][1,4]oxazine-3-carboxamide
CID 125128122
(6S)-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide
CID 125128651
N-butyl-1-[(6S)-6-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carbonyl]piperidine-4-carboxamide
CID 99744584
(6S)-6-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-triazolo[5,1-c][1,4]oxazine-3-carboxamide
CID 125126839
1-(6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carbonyl)-N-(1-phenylethyl)piperidine-4-carboxamide
CID 91889502
N-[1-(4-methoxyphenyl)propyl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide
CID 78798678

Frequently Asked Questions

What is the IUPAC name of (6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide?
The IUPAC name of (6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide (CID 125127257) is (6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide.
What is the SMILES notation for (6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide?
The canonical SMILES for (6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide is CC[C@H](NC(=O)c1ncn2c1CO[C@H](c1ccccc1)C2)c1ccc(OC)cc1.
What is the InChIKey of (6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide?
The InChIKey is LVZOBPIRIHJLCD-FPOVZHCZSA-N. The full InChI is InChI=1S/C23H25N3O3/c1-3-19(16-9-11-18(28-2)12-10-16)25-23(27)22-20-14-29-21(13-26(20)15-24-22)17-7-5-4-6-8-17/h4-12,15,19,21H,3,13-14H2,1-2H3,(H,25,27)/t19-,21-/m0/s1.
What are the key properties of (6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide?
(6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide has a molecular weight of 391.47 g/mol, XLogP of 4.04, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-N-[(1S)-1-(4-methoxyphenyl)propyl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide is sourced from PubChem (CID 125127257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).