(2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide

C18H25N3O4 — CID 51498109

IUPAC(2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide
SMILESCOc1ccccc1C[C@H](C)NC(=O)[C@@H](C)N1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C18H25N3O4/c1-11(10-13-8-6-7-9-14(13)25-5)19-15(22)12(2)21-16(23)18(3,4)20-17(21)24/h6-9,11-12H,10H2,1-5H3,(H,19,22)(H,20,24)/t11-,12+/m0/s1
InChIKeyMTVGLRMLFFHOTO-NWDGAFQWSA-N
MW347.42 g/mol
LogP1.46
Rot. Bonds6

About (2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide

(2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide (PubChem CID 51498109) has the molecular formula C18H25N3O4 and a molecular weight of 347.42 g/mol. Its IUPAC name is (2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide.

Molecular Properties

Compound Name(2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide
PubChem CID51498109
Molecular FormulaC18H25N3O4
Molecular Weight347.42 g/mol
Exact Mass347.18
IUPAC Name(2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide
SMILESCOc1ccccc1C[C@H](C)NC(=O)[C@@H](C)N1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C18H25N3O4/c1-11(10-13-8-6-7-9-14(13)25-5)19-15(22)12(2)21-16(23)18(3,4)20-17(21)24/h6-9,11-12H,10H2,1-5H3,(H,19,22)(H,20,24)/t11-,12+/m0/s1
InChIKeyMTVGLRMLFFHOTO-NWDGAFQWSA-N
XLogP1.46
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methoxyphenyl)propyl]propanamide
CID 51497690
1-(2-methoxyphenyl)propan-2-ylurea
CID 21433825
N-[1-(2-methoxyphenyl)propan-2-yl]-3-oxobutanamide
CID 54867173
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)methyl]propanamide
CID 46963426
3-amino-4-[1-(2-methoxyphenyl)propan-2-ylamino]-4-oxobutanoic acid
CID 64896685
3-chloro-N-[1-(2-methoxyphenyl)propan-2-yl]propanamide
CID 54867469
phenyl N-[1-(2-methoxyphenyl)propan-2-yl]carbamate
CID 61068601
tert-butyl N-[(2R)-1-[[(2S)-1-(2-methoxyphenyl)propan-2-yl]amino]-1-oxopropan-2-yl]carbamate
CID 94811556
4-chloro-N-[1-(2-methoxyphenyl)propan-2-yl]butanamide
CID 63307948
methyl (2S)-2-[1-(2-methoxyphenyl)propan-2-ylamino]propanoate
CID 43786749
[1-(2-methoxyanilino)-1-oxopropan-2-yl] 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)acetate
CID 46786760
2-amino-3,3,3-trifluoro-N-[1-(2-methoxyphenyl)propan-2-yl]-2-methylpropanamide
CID 79792524

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide?
The IUPAC name of (2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide (CID 51498109) is (2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide.
What is the SMILES notation for (2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide?
The canonical SMILES for (2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide is COc1ccccc1C[C@H](C)NC(=O)[C@@H](C)N1C(=O)NC(C)(C)C1=O.
What is the InChIKey of (2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide?
The InChIKey is MTVGLRMLFFHOTO-NWDGAFQWSA-N. The full InChI is InChI=1S/C18H25N3O4/c1-11(10-13-8-6-7-9-14(13)25-5)19-15(22)12(2)21-16(23)18(3,4)20-17(21)24/h6-9,11-12H,10H2,1-5H3,(H,19,22)(H,20,24)/t11-,12+/m0/s1.
What are the key properties of (2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide?
(2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide has a molecular weight of 347.42 g/mol, XLogP of 1.46, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]propanamide is sourced from PubChem (CID 51498109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).