(2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide

C24H35NO3 — CID 100766183

IUPAC(2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide
SMILESCCCC[C@@](C)(OCCC)C(=O)Nc1ccc(OCC(C)C)c2ccccc12
InChIInChI=1S/C24H35NO3/c1-6-8-15-24(5,28-16-7-2)23(26)25-21-13-14-22(27-17-18(3)4)20-12-10-9-11-19(20)21/h9-14,18H,6-8,15-17H2,1-5H3,(H,25,26)/t24-/m1/s1
InChIKeyHJUBNQUPTFEMOV-XMMPIXPASA-N
MW385.55 g/mol
LogP6.19
Rot. Bonds11

About (2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide

(2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide (PubChem CID 100766183) has the molecular formula C24H35NO3 and a molecular weight of 385.55 g/mol. Its IUPAC name is (2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide.

Molecular Properties

Compound Name(2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide
PubChem CID100766183
Molecular FormulaC24H35NO3
Molecular Weight385.55 g/mol
Exact Mass385.26
IUPAC Name(2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide
SMILESCCCC[C@@](C)(OCCC)C(=O)Nc1ccc(OCC(C)C)c2ccccc12
InChIInChI=1S/C24H35NO3/c1-6-8-15-24(5,28-16-7-2)23(26)25-21-13-14-22(27-17-18(3)4)20-12-10-9-11-19(20)21/h9-14,18H,6-8,15-17H2,1-5H3,(H,25,26)/t24-/m1/s1
InChIKeyHJUBNQUPTFEMOV-XMMPIXPASA-N
XLogP6.19
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.55
LogP ≤ 56.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]hexanamide
CID 100761072
(2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide
CID 100760364
2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxyhexanamide
CID 133205372
N-(4-ethoxynaphthalen-1-yl)-2-methyl-2-propoxybutanamide
CID 133204053
2-methoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]propanamide
CID 100752413
(2R)-2-methoxy-N-(4-methoxynaphthalen-1-yl)-2-methylhexanamide
CID 100755111
2-methyl-N-[3-methyl-4-(2-methylpropoxy)phenyl]-2-propoxyheptanamide
CID 133246325
N-(4-butan-2-yloxynaphthalen-1-yl)-2-ethoxy-2-methylheptanamide
CID 133203923
(2S)-2-ethoxy-N-(4-methoxynaphthalen-1-yl)-2-methylheptanamide
CID 100761479
(2S)-N-[4-[(2S)-butan-2-yl]oxynaphthalen-1-yl]-2-methyl-2-propoxybutanamide
CID 100764450
2-methoxy-2-methyl-N-(4-propoxynaphthalen-1-yl)butanamide
CID 133229716
(2R)-N-[2-cyano-4-(2-methylpropoxy)phenyl]-2-methyl-2-propoxyheptanamide
CID 100766555

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide?
The IUPAC name of (2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide (CID 100766183) is (2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide.
What is the SMILES notation for (2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide?
The canonical SMILES for (2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide is CCCC[C@@](C)(OCCC)C(=O)Nc1ccc(OCC(C)C)c2ccccc12.
What is the InChIKey of (2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide?
The InChIKey is HJUBNQUPTFEMOV-XMMPIXPASA-N. The full InChI is InChI=1S/C24H35NO3/c1-6-8-15-24(5,28-16-7-2)23(26)25-21-13-14-22(27-17-18(3)4)20-12-10-9-11-19(20)21/h9-14,18H,6-8,15-17H2,1-5H3,(H,25,26)/t24-/m1/s1.
What are the key properties of (2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide?
(2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide has a molecular weight of 385.55 g/mol, XLogP of 6.19, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide is sourced from PubChem (CID 100766183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).