N-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide

C19H20Cl2N2O2 — CID 3345532

IUPACN-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)C(NCC1CCCO1)c1ccccc1
InChIInChI=1S/C19H20Cl2N2O2/c20-14-9-15(21)11-16(10-14)23-19(24)18(13-5-2-1-3-6-13)22-12-17-7-4-8-25-17/h1-3,5-6,9-11,17-18,22H,4,7-8,12H2,(H,23,24)
InChIKeyLRRQTUSQZIUAFZ-UHFFFAOYSA-N
MW379.29 g/mol
LogP4.44
Rot. Bonds6

About N-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide

N-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide (PubChem CID 3345532) has the molecular formula C19H20Cl2N2O2 and a molecular weight of 379.29 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide
PubChem CID3345532
Molecular FormulaC19H20Cl2N2O2
Molecular Weight379.29 g/mol
Exact Mass378.09
IUPAC NameN-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)C(NCC1CCCO1)c1ccccc1
InChIInChI=1S/C19H20Cl2N2O2/c20-14-9-15(21)11-16(10-14)23-19(24)18(13-5-2-1-3-6-13)22-12-17-7-4-8-25-17/h1-3,5-6,9-11,17-18,22H,4,7-8,12H2,(H,23,24)
InChIKeyLRRQTUSQZIUAFZ-UHFFFAOYSA-N
XLogP4.44
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.29
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-(3-chloro-4-methylphenyl)-2-[[(2S)-oxolan-2-yl]methylamino]-2-phenylacetamide
CID 2442322
1-(3,5-dichlorophenyl)-3-(oxolan-2-ylmethyl)urea
CID 6466967
2-(oxolan-2-ylmethylamino)-2-phenyl-1-pyrrolidin-1-ylethanone
CID 55409532
2-(3-chloro-5-fluorophenyl)-2-(oxolan-2-ylmethylamino)acetic acid
CID 114453653
N-(3,5-dichlorophenyl)-2-phenyl-2-(prop-2-enylamino)acetamide
CID 4883750
ethyl 2-[[(2S)-2-[[(2R)-oxolan-2-yl]methylamino]-2-phenylacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CID 2477592
ethyl 2-[[(2R)-2-[[(2R)-oxolan-2-yl]methylamino]-2-phenylacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CID 2477588
N-(3,5-dichlorophenyl)-5-(oxolan-2-ylmethylamino)pyridine-3-carboxamide
CID 109229072
2-(4-fluorophenyl)-2-(oxolan-2-ylmethylamino)acetic acid
CID 54889961
2-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)acetic acid
CID 54889959
[(1S)-2-(3,5-dimethylanilino)-2-oxo-1-phenylethyl]-[[(2R)-oxolan-2-yl]methyl]azanium
CID 2533764
1-(3,5-dichlorophenyl)-3-[[(2R)-oxolan-2-yl]methyl]thiourea
CID 8658316

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide?
The IUPAC name of N-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide (CID 3345532) is N-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide is O=C(Nc1cc(Cl)cc(Cl)c1)C(NCC1CCCO1)c1ccccc1.
What is the InChIKey of N-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide?
The InChIKey is LRRQTUSQZIUAFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N2O2/c20-14-9-15(21)11-16(10-14)23-19(24)18(13-5-2-1-3-6-13)22-12-17-7-4-8-25-17/h1-3,5-6,9-11,17-18,22H,4,7-8,12H2,(H,23,24).
What are the key properties of N-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide?
N-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide has a molecular weight of 379.29 g/mol, XLogP of 4.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-2-(oxolan-2-ylmethylamino)-2-phenylacetamide is sourced from PubChem (CID 3345532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).