N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide

C16H24N2O2 — CID 66254391

IUPACN-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)Nc1ccc(C)cc1C
InChIInChI=1S/C16H24N2O2/c1-4-7-17-15-10-20-9-13(15)16(19)18-14-6-5-11(2)8-12(14)3/h5-6,8,13,15,17H,4,7,9-10H2,1-3H3,(H,18,19)
InChIKeyUQZGVQISUXNWTR-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.26
Rot. Bonds5

About N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide

N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide (PubChem CID 66254391) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide
PubChem CID66254391
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)Nc1ccc(C)cc1C
InChIInChI=1S/C16H24N2O2/c1-4-7-17-15-10-20-9-13(15)16(19)18-14-6-5-11(2)8-12(14)3/h5-6,8,13,15,17H,4,7,9-10H2,1-3H3,(H,18,19)
InChIKeyUQZGVQISUXNWTR-UHFFFAOYSA-N
XLogP2.26
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromo-2-ethylphenyl)-4-(propylamino)oxolane-3-carboxamide
CID 81287725
N-(2-chloro-4-iodophenyl)-4-(propylamino)oxolane-3-carboxamide
CID 66254611
N-(2-bromo-4-fluorophenyl)-4-(propylamino)oxolane-3-carboxamide
CID 66254786
N-(2-bromo-5-methylphenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 82756801
N-(2-cyano-4-fluorophenyl)-4-(propylamino)oxolane-3-carboxamide
CID 82683106
N-(2,6-dichloro-3-methylphenyl)-4-(propylamino)oxolane-3-carboxamide
CID 66257067
N-(2-hydroxy-5-methoxyphenyl)-4-(propylamino)oxolane-3-carboxamide
CID 102695461
N-(4-fluorophenyl)-4-(propylamino)oxolane-3-carboxamide
CID 66255163
N-(3-fluoro-4-pyridinyl)-4-(propylamino)oxolane-3-carboxamide
CID 107594898
N-(3-carbamoylphenyl)-4-(propylamino)oxolane-3-carboxamide
CID 66256350
N-(2-methylpyrazol-3-yl)-4-(propylamino)oxolane-3-carboxamide
CID 66256735
N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 66259805

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide?
The IUPAC name of N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide (CID 66254391) is N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide is CCCNC1COCC1C(=O)Nc1ccc(C)cc1C.
What is the InChIKey of N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide?
The InChIKey is UQZGVQISUXNWTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-7-17-15-10-20-9-13(15)16(19)18-14-6-5-11(2)8-12(14)3/h5-6,8,13,15,17H,4,7,9-10H2,1-3H3,(H,18,19).
What are the key properties of N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide?
N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-4-(propylamino)oxolane-3-carboxamide is sourced from PubChem (CID 66254391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).