4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide

C16H24N2O2 — CID 66265448

IUPAC4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)NC(C)CCc1ccccc1
InChIInChI=1S/C16H24N2O2/c1-12(8-9-13-6-4-3-5-7-13)18-16(19)14-10-20-11-15(14)17-2/h3-7,12,14-15,17H,8-11H2,1-2H3,(H,18,19)
InChIKeyOSRSOUJQAYTOSQ-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.36
Rot. Bonds6

About 4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide

4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide (PubChem CID 66265448) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide
PubChem CID66265448
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)NC(C)CCc1ccccc1
InChIInChI=1S/C16H24N2O2/c1-12(8-9-13-6-4-3-5-7-13)18-16(19)14-10-20-11-15(14)17-2/h3-7,12,14-15,17H,8-11H2,1-2H3,(H,18,19)
InChIKeyOSRSOUJQAYTOSQ-UHFFFAOYSA-N
XLogP1.36
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(methylamino)-N-[1-(2-methylphenyl)propan-2-yl]oxolane-3-carboxamide
CID 66266793
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
N-heptan-2-yl-4-(methylamino)oxolane-3-carboxamide
CID 66267744
(1S,6R)-3,4-dimethyl-6-[[(2S)-4-phenylbutan-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 7409293
N-[(2S)-4-phenylbutan-2-yl]cyclopropanecarboxamide
CID 844321
2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide
CID 4072324
N-methyl-4-(methylamino)-N-(2-phenylethyl)oxolane-3-carboxamide
CID 66264836
4-(methylamino)-N-[1-(4-propan-2-ylphenyl)ethyl]oxolane-3-carboxamide
CID 66265793
4-amino-N-(1-phenylpropan-2-yl)oxolane-3-carboxamide
CID 66235478
(2R,3R)-3-[[(2R)-4-phenylbutan-2-yl]carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid
CID 124771454
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-(4-phenylbutan-2-yl)oxolane-3-carboxamide?
The IUPAC name of 4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide (CID 66265448) is 4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide.
What is the SMILES notation for 4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide?
The canonical SMILES for 4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide is CNC1COCC1C(=O)NC(C)CCc1ccccc1.
What is the InChIKey of 4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide?
The InChIKey is OSRSOUJQAYTOSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12(8-9-13-6-4-3-5-7-13)18-16(19)14-10-20-11-15(14)17-2/h3-7,12,14-15,17H,8-11H2,1-2H3,(H,18,19).
What are the key properties of 4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide?
4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide is sourced from PubChem (CID 66265448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).