(2R)-2-(phenylmethoxymethyl)decanamide

C18H29NO2 — CID 101216591

IUPAC(2R)-2-(phenylmethoxymethyl)decanamide
SMILESCCCCCCCC[C@H](COCc1ccccc1)C(N)=O
InChIInChI=1S/C18H29NO2/c1-2-3-4-5-6-10-13-17(18(19)20)15-21-14-16-11-8-7-9-12-16/h7-9,11-12,17H,2-6,10,13-15H2,1H3,(H2,19,20)/t17-/m1/s1
InChIKeyLTOVFGGVWQMEPT-QGZVFWFLSA-N
MW291.43 g/mol
LogP4.06
Rot. Bonds12

About (2R)-2-(phenylmethoxymethyl)decanamide

(2R)-2-(phenylmethoxymethyl)decanamide (PubChem CID 101216591) has the molecular formula C18H29NO2 and a molecular weight of 291.43 g/mol. Its IUPAC name is (2R)-2-(phenylmethoxymethyl)decanamide.

Molecular Properties

Compound Name(2R)-2-(phenylmethoxymethyl)decanamide
PubChem CID101216591
Molecular FormulaC18H29NO2
Molecular Weight291.43 g/mol
Exact Mass291.22
IUPAC Name(2R)-2-(phenylmethoxymethyl)decanamide
SMILESCCCCCCCC[C@H](COCc1ccccc1)C(N)=O
InChIInChI=1S/C18H29NO2/c1-2-3-4-5-6-10-13-17(18(19)20)15-21-14-16-11-8-7-9-12-16/h7-9,11-12,17H,2-6,10,13-15H2,1H3,(H2,19,20)/t17-/m1/s1
InChIKeyLTOVFGGVWQMEPT-QGZVFWFLSA-N
XLogP4.06
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.43
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Benzyl 5-amino-5-oxo-3-phenylpentanoate
CID 563203
3-Methyl-3-phenyloxirane-2-carboximidic acid
CID 32382
3-Furamide, tetrahydro-5-oxo-2-phenyl-
CID 25940
Benzyl (3-cyclohexylpropanoylamino) carbonate
CID 177376013
Oxiranecarboxamide, 3-phenyl-, (2R,3S)-rel-
CID 10931765
3-Hydroxy-2-methyl-3-phenylpropanamide
CID 15183457
rac-(2R,3R)-2-phenyloxane-3-carbohydrazide
CID 122154727
3-[(3,4-Difluorophenyl)methoxy]butanamide
CID 91805047
2-[(S)-methoxy(phenyl)methyl]prop-2-enamide
CID 101229694
3-Benzyloxy-4-cyanobutyramide
CID 129829986
(2R)-2-methyl-3-phenylmethoxypropanamide
CID 11148237
Benzyl (2-benzylbut-3-enoylamino) carbonate
CID 13895218

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(phenylmethoxymethyl)decanamide?
The IUPAC name of (2R)-2-(phenylmethoxymethyl)decanamide (CID 101216591) is (2R)-2-(phenylmethoxymethyl)decanamide.
What is the SMILES notation for (2R)-2-(phenylmethoxymethyl)decanamide?
The canonical SMILES for (2R)-2-(phenylmethoxymethyl)decanamide is CCCCCCCC[C@H](COCc1ccccc1)C(N)=O.
What is the InChIKey of (2R)-2-(phenylmethoxymethyl)decanamide?
The InChIKey is LTOVFGGVWQMEPT-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H29NO2/c1-2-3-4-5-6-10-13-17(18(19)20)15-21-14-16-11-8-7-9-12-16/h7-9,11-12,17H,2-6,10,13-15H2,1H3,(H2,19,20)/t17-/m1/s1.
What are the key properties of (2R)-2-(phenylmethoxymethyl)decanamide?
(2R)-2-(phenylmethoxymethyl)decanamide has a molecular weight of 291.43 g/mol, XLogP of 4.06, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(phenylmethoxymethyl)decanamide is sourced from PubChem (CID 101216591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).