(2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide

C18H29NO3 — CID 100722919

IUPAC(2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide
SMILESCCO[C@](C)(CC(C)C)C(=O)Nc1ccc(OC(C)C)cc1
InChIInChI=1S/C18H29NO3/c1-7-21-18(6,12-13(2)3)17(20)19-15-8-10-16(11-9-15)22-14(4)5/h8-11,13-14H,7,12H2,1-6H3,(H,19,20)/t18-/m1/s1
InChIKeyWFGOUSDLZDCQKJ-GOSISDBHSA-N
MW307.43 g/mol
LogP4.25
Rot. Bonds8

About (2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide

(2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide (PubChem CID 100722919) has the molecular formula C18H29NO3 and a molecular weight of 307.43 g/mol. Its IUPAC name is (2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide.

Molecular Properties

Compound Name(2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide
PubChem CID100722919
Molecular FormulaC18H29NO3
Molecular Weight307.43 g/mol
Exact Mass307.21
IUPAC Name(2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide
SMILESCCO[C@](C)(CC(C)C)C(=O)Nc1ccc(OC(C)C)cc1
InChIInChI=1S/C18H29NO3/c1-7-21-18(6,12-13(2)3)17(20)19-15-8-10-16(11-9-15)22-14(4)5/h8-11,13-14H,7,12H2,1-6H3,(H,19,20)/t18-/m1/s1
InChIKeyWFGOUSDLZDCQKJ-GOSISDBHSA-N
XLogP4.25
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.43
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide
CID 100722911
(2S)-2-ethoxy-2,4-dimethyl-N-(4-propoxyphenyl)pentanamide
CID 100722896
2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]-2,4-dimethylpentanamide
CID 133246574
(2S)-N-[4-[(2R)-butan-2-yl]oxyphenyl]-2,4-dimethyl-2-propoxypentanamide
CID 100738354
(2R)-N-[4-[(2S)-butan-2-yl]oxyphenyl]-2,4-dimethyl-2-propoxypentanamide
CID 100738347
N-(4-butan-2-yloxyphenyl)-2-ethoxy-2-methylbutanamide
CID 133246278
2-methyl-N-(4-propan-2-yloxyphenyl)-2-propoxybutanamide
CID 133203827
(2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)phenyl]butanamide
CID 100710857
(2S)-2-methoxy-2-methyl-N-(4-propan-2-yloxyphenyl)hexanamide
CID 100699590
2-ethoxy-N-(4-ethoxy-3-methylphenyl)-2,4-dimethylpentanamide
CID 133246576
(2R)-2-ethoxy-N-(4-methoxy-3-methylphenyl)-2,4-dimethylpentanamide
CID 100723689
(2R)-N-[4-[(2S)-butan-2-yl]oxy-3-methylphenyl]-2-ethoxy-2,4-dimethylpentanamide
CID 100723785

Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide?
The IUPAC name of (2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide (CID 100722919) is (2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide.
What is the SMILES notation for (2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide?
The canonical SMILES for (2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide is CCO[C@](C)(CC(C)C)C(=O)Nc1ccc(OC(C)C)cc1.
What is the InChIKey of (2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide?
The InChIKey is WFGOUSDLZDCQKJ-GOSISDBHSA-N. The full InChI is InChI=1S/C18H29NO3/c1-7-21-18(6,12-13(2)3)17(20)19-15-8-10-16(11-9-15)22-14(4)5/h8-11,13-14H,7,12H2,1-6H3,(H,19,20)/t18-/m1/s1.
What are the key properties of (2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide?
(2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide has a molecular weight of 307.43 g/mol, XLogP of 4.25, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethoxy-2,4-dimethyl-N-(4-propan-2-yloxyphenyl)pentanamide is sourced from PubChem (CID 100722919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).