N-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide

C17H26N2O2 — CID 66256169

IUPACN-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)N(C)c1cc(C)cc(C)c1
InChIInChI=1S/C17H26N2O2/c1-5-6-18-16-11-21-10-15(16)17(20)19(4)14-8-12(2)7-13(3)9-14/h7-9,15-16,18H,5-6,10-11H2,1-4H3
InChIKeyUZVHKPWMSPAHMH-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.28
Rot. Bonds5

About N-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide

N-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide (PubChem CID 66256169) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide
PubChem CID66256169
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)N(C)c1cc(C)cc(C)c1
InChIInChI=1S/C17H26N2O2/c1-5-6-18-16-11-21-10-15(16)17(20)19(4)14-8-12(2)7-13(3)9-14/h7-9,15-16,18H,5-6,10-11H2,1-4H3
InChIKeyUZVHKPWMSPAHMH-UHFFFAOYSA-N
XLogP2.28
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-dimethylphenyl)-4-(ethylamino)-N-methyloxolane-3-carboxamide
CID 66260067
N-(4-cyanophenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide
CID 66255223
2-(3,5-dimethylphenyl)-1-[4-(propylamino)oxolan-3-yl]ethanone
CID 116587669
N-ethyl-4-(propylamino)-N-pyridin-4-yloxolane-3-carboxamide
CID 106935566
2-[methyl-[4-(propylamino)oxolane-3-carbonyl]amino]propanoic acid
CID 66255984
N-cyclohexyl-N-methyl-4-(propylamino)oxolane-3-carboxamide
CID 66257070
N-(2-methoxyethyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide
CID 66254816
N-[(2-hydroxyphenyl)methyl]-N-methyl-4-(propylamino)oxolane-3-carboxamide
CID 66254812
N-methyl-N-[3-(methylamino)-3-oxopropyl]-4-(propylamino)oxolane-3-carboxamide
CID 106915220
2-[methyl-[4-(propylamino)oxolane-3-carbonyl]amino]butanoic acid
CID 66256930
2-[propyl-[4-(propylamino)oxolane-3-carbonyl]amino]acetic acid
CID 66256929
4-[[4-(ethylamino)oxolane-3-carbonyl]-methylamino]benzoic acid
CID 104698721

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide?
The IUPAC name of N-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide (CID 66256169) is N-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide is CCCNC1COCC1C(=O)N(C)c1cc(C)cc(C)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide?
The InChIKey is UZVHKPWMSPAHMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-5-6-18-16-11-21-10-15(16)17(20)19(4)14-8-12(2)7-13(3)9-14/h7-9,15-16,18H,5-6,10-11H2,1-4H3.
What are the key properties of N-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide?
N-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide is sourced from PubChem (CID 66256169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).