N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide

C23H24N2O3 — CID 43068285

IUPACN-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide
SMILESCCC(C(=O)Nc1ccc(OC)c(OCc2ccncc2)c1)c1ccccc1
InChIInChI=1S/C23H24N2O3/c1-3-20(18-7-5-4-6-8-18)23(26)25-19-9-10-21(27-2)22(15-19)28-16-17-11-13-24-14-12-17/h4-15,20H,3,16H2,1-2H3,(H,25,26)
InChIKeyCVSSTJCLEBCRCG-UHFFFAOYSA-N
MW376.46 g/mol
LogP4.80
Rot. Bonds8

About N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide

N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide (PubChem CID 43068285) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide.

Molecular Properties

Compound NameN-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide
PubChem CID43068285
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC NameN-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide
SMILESCCC(C(=O)Nc1ccc(OC)c(OCc2ccncc2)c1)c1ccccc1
InChIInChI=1S/C23H24N2O3/c1-3-20(18-7-5-4-6-8-18)23(26)25-19-9-10-21(27-2)22(15-19)28-16-17-11-13-24-14-12-17/h4-15,20H,3,16H2,1-2H3,(H,25,26)
InChIKeyCVSSTJCLEBCRCG-UHFFFAOYSA-N
XLogP4.80
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-2-methylbutanamide
CID 42958626
(4-methoxy-3-phenylmethoxyphenyl)carbamic acid
CID 155170089
4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
CID 43068273
N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-1-benzofuran-2-carboxamide
CID 43068293
N-[2-[4-methoxy-3-(pyridin-4-ylmethoxy)anilino]-2-oxoethyl]-4-phenylbenzamide
CID 38629097
4-tert-butyl-N-[1-[4-methoxy-3-(pyridin-4-ylmethoxy)anilino]-1-oxopropan-2-yl]benzamide
CID 55679486
2-(4-chlorophenyl)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]acetamide
CID 38628569
3,5-dichloro-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
CID 46427791
N-[(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]-2-phenylbutanamide
CID 5058487
N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-3,5-dimethyl-1-phenylpyrazole-4-carboxamide
CID 33125978
N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 55642482
1-benzyl-5-ethyl-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]pyrazole-4-carboxamide
CID 78873277

Frequently Asked Questions

What is the IUPAC name of N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide?
The IUPAC name of N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide (CID 43068285) is N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide.
What is the SMILES notation for N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide?
The canonical SMILES for N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide is CCC(C(=O)Nc1ccc(OC)c(OCc2ccncc2)c1)c1ccccc1.
What is the InChIKey of N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide?
The InChIKey is CVSSTJCLEBCRCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3/c1-3-20(18-7-5-4-6-8-18)23(26)25-19-9-10-21(27-2)22(15-19)28-16-17-11-13-24-14-12-17/h4-15,20H,3,16H2,1-2H3,(H,25,26).
What are the key properties of N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide?
N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide has a molecular weight of 376.46 g/mol, XLogP of 4.80, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-phenylbutanamide is sourced from PubChem (CID 43068285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).