4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide

C23H23N3O4 — CID 56546047

IUPAC4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide
SMILESCC(C)Oc1ccc(CNC(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)cn1
InChIInChI=1S/C23H23N3O4/c1-15(2)29-21-12-3-16(13-25-21)14-26-23(28)18-6-10-20(11-7-18)30-19-8-4-17(5-9-19)22(24)27/h3-13,15H,14H2,1-2H3,(H2,24,27)(H,26,28)
InChIKeyUVWZRHUVHRDTMB-UHFFFAOYSA-N
MW405.45 g/mol
LogP3.69
Rot. Bonds8

About 4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide

4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide (PubChem CID 56546047) has the molecular formula C23H23N3O4 and a molecular weight of 405.45 g/mol. Its IUPAC name is 4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide.

Molecular Properties

Compound Name4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide
PubChem CID56546047
Molecular FormulaC23H23N3O4
Molecular Weight405.45 g/mol
Exact Mass405.17
IUPAC Name4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide
SMILESCC(C)Oc1ccc(CNC(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)cn1
InChIInChI=1S/C23H23N3O4/c1-15(2)29-21-12-3-16(13-25-21)14-26-23(28)18-6-10-20(11-7-18)30-19-8-4-17(5-9-19)22(24)27/h3-13,15H,14H2,1-2H3,(H2,24,27)(H,26,28)
InChIKeyUVWZRHUVHRDTMB-UHFFFAOYSA-N
XLogP3.69
TPSA103.54 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.45
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[[5-[(propan-2-ylamino)methyl]-2-pyridinyl]oxy]benzamide
CID 80637430
N-[(6-propan-2-yloxy-3-pyridinyl)methyl]thiophene-3-carboxamide
CID 47042880
3,4,5-trimethoxy-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]benzamide
CID 47042876
4-[[5-[(3-methylbutylamino)methyl]-2-pyridinyl]oxy]benzamide
CID 59730124
1-N,4-N-bis[(6-methoxy-3-pyridinyl)methyl]benzene-1,4-dicarboxamide
CID 24646071
2-(6-propan-2-yloxy-3-pyridinyl)acetamide
CID 173496816
4-[(4-fluorophenyl)sulfonylamino]-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]benzamide
CID 55847190
3-methoxy-N-[(6-methoxy-3-pyridinyl)methyl]-4-propan-2-yloxybenzamide
CID 51306028
2-(2-amino-2-oxoethyl)sulfanyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]benzamide
CID 55747594
methyl N-[4-[[[4-(4-carbamoylphenoxy)benzoyl]amino]methyl]phenyl]carbamate
CID 56548905
(2S)-2-methylsulfonyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]propanamide
CID 94173164
N-[(4-ethoxyphenyl)methyl]-4-propan-2-yloxybenzamide
CID 53282891

Frequently Asked Questions

What is the IUPAC name of 4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide?
The IUPAC name of 4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide (CID 56546047) is 4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide.
What is the SMILES notation for 4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide?
The canonical SMILES for 4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide is CC(C)Oc1ccc(CNC(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)cn1.
What is the InChIKey of 4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide?
The InChIKey is UVWZRHUVHRDTMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O4/c1-15(2)29-21-12-3-16(13-25-21)14-26-23(28)18-6-10-20(11-7-18)30-19-8-4-17(5-9-19)22(24)27/h3-13,15H,14H2,1-2H3,(H2,24,27)(H,26,28).
What are the key properties of 4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide?
4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide has a molecular weight of 405.45 g/mol, XLogP of 3.69, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[(6-propan-2-yloxy-3-pyridinyl)methylcarbamoyl]phenoxy]benzamide is sourced from PubChem (CID 56546047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).