2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline

C19H24N2O3 — CID 139501105

IUPAC2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline
SMILESCC1(C)ON(c2ccc(OCc3ccccc3)c(N)c2)OC1(C)C
InChIInChI=1S/C19H24N2O3/c1-18(2)19(3,4)24-21(23-18)15-10-11-17(16(20)12-15)22-13-14-8-6-5-7-9-14/h5-12H,13,20H2,1-4H3
InChIKeyPIWZGJWJXTZBHC-UHFFFAOYSA-N
MW328.41 g/mol
LogP4.09
Rot. Bonds4

About 2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline

2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline (PubChem CID 139501105) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline.

Molecular Properties

Compound Name2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline
PubChem CID139501105
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline
SMILESCC1(C)ON(c2ccc(OCc3ccccc3)c(N)c2)OC1(C)C
InChIInChI=1S/C19H24N2O3/c1-18(2)19(3,4)24-21(23-18)15-10-11-17(16(20)12-15)22-13-14-8-6-5-7-9-14/h5-12H,13,20H2,1-4H3
InChIKeyPIWZGJWJXTZBHC-UHFFFAOYSA-N
XLogP4.09
TPSA56.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(dimethoxymethyl)-2-phenylmethoxyaniline
CID 154099564
1-(3-chloro-4-phenylmethoxyphenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine;hydrochloride
CID 134103228
4-iodo-2-phenylmethoxyaniline
CID 66756754
3-phenylmethoxybenzene-1,2-diamine;hydrochloride
CID 172882825
3-methoxy-4-phenylmethoxyaniline
CID 27226
2-phenylmethoxy-5-[3-(propan-2-ylamino)propyl]aniline
CID 82153119
4-[4-(3-amino-4-phenylmethoxyphenyl)-2,5-dimethoxyphenyl]phenol
CID 23538933
5-[(5-methyl-1,3-thiazol-2-yl)methyl]-2-phenylmethoxyaniline
CID 94758883
2,3,6,7,10,11-hexakis(phenylmethoxy)triphenylene
CID 11040205
5-[3-(2-methylpropylamino)propyl]-2-phenylmethoxyaniline
CID 94759766
ethane;3-(3-fluoro-4-phenylmethoxyphenyl)-1,3-oxazolidin-2-one;methanol
CID 142959688
2-phenylmethoxy-5-[2-(prop-2-enylamino)ethyl]aniline
CID 82257717

Frequently Asked Questions

What is the IUPAC name of 2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline?
The IUPAC name of 2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline (CID 139501105) is 2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline.
What is the SMILES notation for 2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline?
The canonical SMILES for 2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline is CC1(C)ON(c2ccc(OCc3ccccc3)c(N)c2)OC1(C)C.
What is the InChIKey of 2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline?
The InChIKey is PIWZGJWJXTZBHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-18(2)19(3,4)24-21(23-18)15-10-11-17(16(20)12-15)22-13-14-8-6-5-7-9-14/h5-12H,13,20H2,1-4H3.
What are the key properties of 2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline?
2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline has a molecular weight of 328.41 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)aniline is sourced from PubChem (CID 139501105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).