N-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide

C27H29N3O3 — CID 54843435

IUPACN-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide
SMILESO=C(CNc1cccc(C(=O)N2CCCCC2)c1)Nc1ccccc1OCc1ccccc1
InChIInChI=1S/C27H29N3O3/c31-26(29-24-14-5-6-15-25(24)33-20-21-10-3-1-4-11-21)19-28-23-13-9-12-22(18-23)27(32)30-16-7-2-8-17-30/h1,3-6,9-15,18,28H,2,7-8,16-17,19-20H2,(H,29,31)
InChIKeyJDHLHMTXBBSRKP-UHFFFAOYSA-N
MW443.55 g/mol
LogP4.94
Rot. Bonds8

About N-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide

N-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide (PubChem CID 54843435) has the molecular formula C27H29N3O3 and a molecular weight of 443.55 g/mol. Its IUPAC name is N-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide.

Molecular Properties

Compound NameN-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide
PubChem CID54843435
Molecular FormulaC27H29N3O3
Molecular Weight443.55 g/mol
Exact Mass443.22
IUPAC NameN-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide
SMILESO=C(CNc1cccc(C(=O)N2CCCCC2)c1)Nc1ccccc1OCc1ccccc1
InChIInChI=1S/C27H29N3O3/c31-26(29-24-14-5-6-15-25(24)33-20-21-10-3-1-4-11-21)19-28-23-13-9-12-22(18-23)27(32)30-16-7-2-8-17-30/h1,3-6,9-15,18,28H,2,7-8,16-17,19-20H2,(H,29,31)
InChIKeyJDHLHMTXBBSRKP-UHFFFAOYSA-N
XLogP4.94
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.55
LogP ≤ 54.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(azepane-1-carbonyl)anilino]-N-(2-phenylmethoxyphenyl)acetamide
CID 54834877
N-cyclohexyl-3-[[2-oxo-2-(2-phenylmethoxyanilino)ethyl]amino]benzamide
CID 54830968
2-[4-(azepane-1-carbonyl)anilino]-N-[2-(3-phenylpropoxy)phenyl]acetamide
CID 54835286
N-[3-(2-phenylethoxy)phenyl]-2-[3-(pyrrolidine-1-carbonyl)anilino]acetamide
CID 54841151
2-(3-acetamidoanilino)-N-(2-phenylmethoxyphenyl)acetamide
CID 54831747
N-(3-chloro-2-methylphenyl)-2-[3-(pyrrolidine-1-carbonyl)anilino]acetamide
CID 34085061
N-[3-(4-methylpiperidine-1-carbonyl)phenyl]-2-(3-phenylmethoxyanilino)acetamide
CID 54826640
3-[[2-[3-(azepane-1-carbonyl)anilino]-2-oxoethyl]amino]-N-benzylbenzamide
CID 54844455
2-[4-(azepane-1-carbonyl)anilino]-N-(2-ethoxyphenyl)acetamide
CID 54835054
N-[2-(2-methylpropoxy)phenyl]-2-[3-(morpholine-4-carbonyl)anilino]acetamide
CID 54836401
N-[3-[[2-[3-(pyrrolidine-1-carbonyl)anilino]acetyl]amino]phenyl]benzamide
CID 54841067
N-benzyl-4-[[2-[3-(piperidine-1-carbonyl)anilino]acetyl]amino]benzamide
CID 54843316

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide?
The IUPAC name of N-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide (CID 54843435) is N-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide.
What is the SMILES notation for N-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide?
The canonical SMILES for N-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide is O=C(CNc1cccc(C(=O)N2CCCCC2)c1)Nc1ccccc1OCc1ccccc1.
What is the InChIKey of N-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide?
The InChIKey is JDHLHMTXBBSRKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H29N3O3/c31-26(29-24-14-5-6-15-25(24)33-20-21-10-3-1-4-11-21)19-28-23-13-9-12-22(18-23)27(32)30-16-7-2-8-17-30/h1,3-6,9-15,18,28H,2,7-8,16-17,19-20H2,(H,29,31).
What are the key properties of N-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide?
N-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide has a molecular weight of 443.55 g/mol, XLogP of 4.94, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylmethoxyphenyl)-2-[3-(piperidine-1-carbonyl)anilino]acetamide is sourced from PubChem (CID 54843435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).