N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide

C15H20Cl2N2O2 — CID 66257067

IUPACN-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)Nc1c(Cl)ccc(C)c1Cl
InChIInChI=1S/C15H20Cl2N2O2/c1-3-6-18-12-8-21-7-10(12)15(20)19-14-11(16)5-4-9(2)13(14)17/h4-5,10,12,18H,3,6-8H2,1-2H3,(H,19,20)
InChIKeyDVJPKAXNKHQSNA-UHFFFAOYSA-N
MW331.24 g/mol
LogP3.25
Rot. Bonds5

About N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide

N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide (PubChem CID 66257067) has the molecular formula C15H20Cl2N2O2 and a molecular weight of 331.24 g/mol. Its IUPAC name is N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide
PubChem CID66257067
Molecular FormulaC15H20Cl2N2O2
Molecular Weight331.24 g/mol
Exact Mass330.09
IUPAC NameN-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)Nc1c(Cl)ccc(C)c1Cl
InChIInChI=1S/C15H20Cl2N2O2/c1-3-6-18-12-8-21-7-10(12)15(20)19-14-11(16)5-4-9(2)13(14)17/h4-5,10,12,18H,3,6-8H2,1-2H3,(H,19,20)
InChIKeyDVJPKAXNKHQSNA-UHFFFAOYSA-N
XLogP3.25
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.24
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chloro-6-methylphenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 66254364
N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide
CID 66254391
N-(2-chloro-4-iodophenyl)-4-(propylamino)oxolane-3-carboxamide
CID 66254611
N-(4-fluorophenyl)-4-(propylamino)oxolane-3-carboxamide
CID 66255163
2-(2,5-dichlorophenyl)-1-[4-(propylamino)oxolan-3-yl]ethanone
CID 116587823
N-[(1R)-1-(2-methylphenyl)ethyl]-4-(propylamino)oxolane-3-carboxamide
CID 81363941
N-(2-methylpyrazol-3-yl)-4-(propylamino)oxolane-3-carboxamide
CID 66256735
N-[(1R)-1-(4-chlorophenyl)ethyl]-4-(propylamino)oxolane-3-carboxamide
CID 81357106
N-(3-carbamoylphenyl)-4-(propylamino)oxolane-3-carboxamide
CID 66256350
N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide
CID 66256902
N-(4-bromo-2-ethylphenyl)-4-(propylamino)oxolane-3-carboxamide
CID 81287725
N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 66259041

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide?
The IUPAC name of N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide (CID 66257067) is N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide.
What is the SMILES notation for N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide?
The canonical SMILES for N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide is CCCNC1COCC1C(=O)Nc1c(Cl)ccc(C)c1Cl.
What is the InChIKey of N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide?
The InChIKey is DVJPKAXNKHQSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O2/c1-3-6-18-12-8-21-7-10(12)15(20)19-14-11(16)5-4-9(2)13(14)17/h4-5,10,12,18H,3,6-8H2,1-2H3,(H,19,20).
What are the key properties of N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide?
N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide has a molecular weight of 331.24 g/mol, XLogP of 3.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide is sourced from PubChem (CID 66257067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).