N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide

C19H22N2O3 — CID 3071633

IUPACN-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESCOc1ccc2cccc(CCNC(=O)CN3CCCC3=O)c2c1
InChIInChI=1S/C19H22N2O3/c1-24-16-8-7-14-4-2-5-15(17(14)12-16)9-10-20-18(22)13-21-11-3-6-19(21)23/h2,4-5,7-8,12H,3,6,9-11,13H2,1H3,(H,20,22)
InChIKeySCEQZMXPNMSSRD-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.13
Rot. Bonds6

About N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide

N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide (PubChem CID 3071633) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
PubChem CID3071633
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESCOc1ccc2cccc(CCNC(=O)CN3CCCC3=O)c2c1
InChIInChI=1S/C19H22N2O3/c1-24-16-8-7-14-4-2-5-15(17(14)12-16)9-10-20-18(22)13-21-11-3-6-19(21)23/h2,4-5,7-8,12H,3,6,9-11,13H2,1H3,(H,20,22)
InChIKeySCEQZMXPNMSSRD-UHFFFAOYSA-N
XLogP2.13
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Agomelatine
CID 82148
Propanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071631
Butanamide, 4-chloro-N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071634
2-Pyrrolidinone, 1-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071635
Acetamide, 2-bromo-N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071636
Butanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071652
N-[2-(2-Methoxy-1-naphthyl)ethyl]trifluoroacetamide
CID 11779359
N-cyclopropylcarbonyl-2-(7-methoxy-1-naphthyl)ethylamine
CID 164405
Propanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-2-methyl-
CID 3071630
Pentanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071632
4-Morpholineacetamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071637
Acetamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-N-methyl-
CID 3071638

Frequently Asked Questions

What is the IUPAC name of N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The IUPAC name of N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide (CID 3071633) is N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The canonical SMILES for N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide is COc1ccc2cccc(CCNC(=O)CN3CCCC3=O)c2c1.
What is the InChIKey of N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The InChIKey is SCEQZMXPNMSSRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-24-16-8-7-14-4-2-5-15(17(14)12-16)9-10-20-18(22)13-21-11-3-6-19(21)23/h2,4-5,7-8,12H,3,6,9-11,13H2,1H3,(H,20,22).
What are the key properties of N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide has a molecular weight of 326.40 g/mol, XLogP of 2.13, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide is sourced from PubChem (CID 3071633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).