N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide

C25H29N3O2 — CID 38124429

IUPACN-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide
SMILESCCN(C(=O)CN1CCN(c2cccc(OC)c2)CC1)c1cccc2ccccc12
InChIInChI=1S/C25H29N3O2/c1-3-28(24-13-6-9-20-8-4-5-12-23(20)24)25(29)19-26-14-16-27(17-15-26)21-10-7-11-22(18-21)30-2/h4-13,18H,3,14-17,19H2,1-2H3
InChIKeyPCMXMOWVIPLTGX-UHFFFAOYSA-N
MW403.53 g/mol
LogP4.02
Rot. Bonds6

About N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide

N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide (PubChem CID 38124429) has the molecular formula C25H29N3O2 and a molecular weight of 403.53 g/mol. Its IUPAC name is N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide
PubChem CID38124429
Molecular FormulaC25H29N3O2
Molecular Weight403.53 g/mol
Exact Mass403.23
IUPAC NameN-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide
SMILESCCN(C(=O)CN1CCN(c2cccc(OC)c2)CC1)c1cccc2ccccc12
InChIInChI=1S/C25H29N3O2/c1-3-28(24-13-6-9-20-8-4-5-12-23(20)24)25(29)19-26-14-16-27(17-15-26)21-10-7-11-22(18-21)30-2/h4-13,18H,3,14-17,19H2,1-2H3
InChIKeyPCMXMOWVIPLTGX-UHFFFAOYSA-N
XLogP4.02
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.53
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-ethyl-N-naphthalen-1-ylacetamide
CID 36846496
2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-methyl-N-[(1R)-1-phenylethyl]acetamide
CID 9348034
2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-phenyl-N-propan-2-ylacetamide
CID 8592399
N-butan-2-yl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 17401834
N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 78787987
N-ethyl-N-(2-methylphenyl)-2-[4-(3-nitrophenyl)piperazin-1-yl]acetamide
CID 55739191
propan-2-yl 2-[4-(3-methoxyphenyl)piperazin-1-yl]acetate
CID 60690618
N-ethyl-2-[3-(3-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-naphthalen-1-ylacetamide
CID 2373680
N-ethyl-2-[4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)piperazin-1-yl]-N-naphthalen-1-ylacetamide
CID 18150335
N-[(2-methoxyphenyl)methyl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 8592411
2-[4-(4-methoxyphenyl)piperazin-1-yl]-N,N-diphenylacetamide
CID 3040739
N-(4-acetamidophenyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 41312804

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide?
The IUPAC name of N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide (CID 38124429) is N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide.
What is the SMILES notation for N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide?
The canonical SMILES for N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide is CCN(C(=O)CN1CCN(c2cccc(OC)c2)CC1)c1cccc2ccccc12.
What is the InChIKey of N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide?
The InChIKey is PCMXMOWVIPLTGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N3O2/c1-3-28(24-13-6-9-20-8-4-5-12-23(20)24)25(29)19-26-14-16-27(17-15-26)21-10-7-11-22(18-21)30-2/h4-13,18H,3,14-17,19H2,1-2H3.
What are the key properties of N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide?
N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide has a molecular weight of 403.53 g/mol, XLogP of 4.02, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide is sourced from PubChem (CID 38124429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).