4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide

C16H24N2O2 — CID 66266793

IUPAC4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)NC(C)Cc1ccccc1C
InChIInChI=1S/C16H24N2O2/c1-11-6-4-5-7-13(11)8-12(2)18-16(19)14-9-20-10-15(14)17-3/h4-7,12,14-15,17H,8-10H2,1-3H3,(H,18,19)
InChIKeyQSXZIZLHTXMKCN-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.28
Rot. Bonds5

About 4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide

4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide (PubChem CID 66266793) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide.

Molecular Properties

Compound Name4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide
PubChem CID66266793
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)NC(C)Cc1ccccc1C
InChIInChI=1S/C16H24N2O2/c1-11-6-4-5-7-13(11)8-12(2)18-16(19)14-9-20-10-15(14)17-3/h4-7,12,14-15,17H,8-10H2,1-3H3,(H,18,19)
InChIKeyQSXZIZLHTXMKCN-UHFFFAOYSA-N
XLogP1.28
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 ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide
CID 66265448
N-[1-(2-chlorophenyl)propan-2-yl]-4-(ethylamino)oxolane-3-carboxamide
CID 66257504
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-4-(methylamino)oxolane-3-carboxamide
CID 107860965
2-[[4-(methylamino)oxolane-3-carbonyl]amino]-2-phenylacetic acid
CID 66267213
4-(methylamino)-N-[1-(4-propan-2-ylphenyl)ethyl]oxolane-3-carboxamide
CID 66265793
N-heptan-2-yl-4-(methylamino)oxolane-3-carboxamide
CID 66267744
N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 541803
2-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 60927229
4-(ethylamino)-N-[(1S)-1-(2-methylphenyl)ethyl]oxolane-3-carboxamide
CID 81379978
4-(ethylamino)-N-[(2-methylphenyl)methyl]oxolane-3-carboxamide
CID 66258098
4-(methylamino)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]oxolane-3-carboxamide
CID 66266779
4-(methylamino)-N-(2-methyl-1-thiophen-2-ylpropyl)oxolane-3-carboxamide
CID 66265401

Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide?
The IUPAC name of 4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide (CID 66266793) is 4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide.
What is the SMILES notation for 4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide?
The canonical SMILES for 4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide is CNC1COCC1C(=O)NC(C)Cc1ccccc1C.
What is the InChIKey of 4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide?
The InChIKey is QSXZIZLHTXMKCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-11-6-4-5-7-13(11)8-12(2)18-16(19)14-9-20-10-15(14)17-3/h4-7,12,14-15,17H,8-10H2,1-3H3,(H,18,19).
What are the key properties of 4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide?
4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.28, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide is sourced from PubChem (CID 66266793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).