4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide

C15H22N2O3 — CID 66263893

IUPAC4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide
SMILESCC1(C(=O)NC(CO)Cc2ccccc2)COCC1N
InChIInChI=1S/C15H22N2O3/c1-15(10-20-9-13(15)16)14(19)17-12(8-18)7-11-5-3-2-4-6-11/h2-6,12-13,18H,7-10,16H2,1H3,(H,17,19)
InChIKeyPQLRXZVEVGCJLP-UHFFFAOYSA-N
MW278.35 g/mol
LogP0.07
Rot. Bonds5

About 4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide

4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide (PubChem CID 66263893) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide
PubChem CID66263893
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide
SMILESCC1(C(=O)NC(CO)Cc2ccccc2)COCC1N
InChIInChI=1S/C15H22N2O3/c1-15(10-20-9-13(15)16)14(19)17-12(8-18)7-11-5-3-2-4-6-11/h2-6,12-13,18H,7-10,16H2,1H3,(H,17,19)
InChIKeyPQLRXZVEVGCJLP-UHFFFAOYSA-N
XLogP0.07
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 50.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-[2-(dimethylamino)-1-phenylethyl]-3-methyloxolane-3-carboxamide
CID 66250851
4-amino-N-(1-hydroxy-3-methylbutan-2-yl)-3-methyloxolane-3-carboxamide
CID 79249257
4-amino-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]oxolane-3-carboxamide
CID 107863151
4-amino-N-(dicyclopropylmethyl)-3-methyloxolane-3-carboxamide
CID 66250852
4-(aminomethyl)-N-(1-hydroxy-3-phenylpropan-2-yl)oxane-4-carboxamide
CID 115439571
4-amino-N-(2-ethylphenyl)-3-methyloxolane-3-carboxamide
CID 66250197
N-(1-hydroxy-3-phenylpropan-2-yl)-3-methylpyrrolidine-3-carboxamide
CID 63261449
2-N,2-N'-bis[(2S)-1-hydroxy-3-phenylpropan-2-yl]-1,3-dihydroindene-2,2-dicarboxamide
CID 24746259
1-ethyl-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]cyclopentane-1-carboxamide
CID 102677400
(2S)-2-[(4-amino-3-methyloxolane-3-carbonyl)amino]pentanoic acid
CID 107565154
(2S)-4-amino-2-[(4-amino-3-methyloxolane-3-carbonyl)amino]-4-oxobutanoic acid
CID 114005176
4-amino-N-benzyl-N-cyclopropyl-3-methyloxolane-3-carboxamide
CID 66250990

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide?
The IUPAC name of 4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide (CID 66263893) is 4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide is CC1(C(=O)NC(CO)Cc2ccccc2)COCC1N.
What is the InChIKey of 4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide?
The InChIKey is PQLRXZVEVGCJLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-15(10-20-9-13(15)16)14(19)17-12(8-18)7-11-5-3-2-4-6-11/h2-6,12-13,18H,7-10,16H2,1H3,(H,17,19).
What are the key properties of 4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide?
4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 0.07, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide is sourced from PubChem (CID 66263893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).