N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide

C17H19N3O3 — CID 57250366

IUPACN-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide
SMILESCOc1ccc2cccc(CCNC(=O)C3CNC(=O)N3)c2c1
InChIInChI=1S/C17H19N3O3/c1-23-13-6-5-11-3-2-4-12(14(11)9-13)7-8-18-16(21)15-10-19-17(22)20-15/h2-6,9,15H,7-8,10H2,1H3,(H,18,21)(H2,19,20,22)
InChIKeyJSOWVENVGHFWKX-UHFFFAOYSA-N
MW313.36 g/mol
LogP1.19
Rot. Bonds5

About N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide

N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide (PubChem CID 57250366) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide
PubChem CID57250366
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC NameN-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide
SMILESCOc1ccc2cccc(CCNC(=O)C3CNC(=O)N3)c2c1
InChIInChI=1S/C17H19N3O3/c1-23-13-6-5-11-3-2-4-12(14(11)9-13)7-8-18-16(21)15-10-19-17(22)20-15/h2-6,9,15H,7-8,10H2,1H3,(H,18,21)(H2,19,20,22)
InChIKeyJSOWVENVGHFWKX-UHFFFAOYSA-N
XLogP1.19
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 51.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 139057200
methanol;N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 174597749
N-[3-(7-methoxynaphthalen-1-yl)propyl]cyclopentanecarboxamide
CID 19086062
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide;sulfuric acid
CID 71529133
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide;propanedioic acid
CID 71477284
(4R)-N-[[4-methoxy-2-(trifluoromethyl)phenyl]methyl]-2-oxoimidazolidine-4-carboxamide
CID 97063377
N-[2-(7-methoxynaphthalen-1-yl)ethyl]-4-methylpiperazine-1-carboxamide
CID 90670904
2-(7-methoxynaphthalen-1-yl)-N-methylethanamine
CID 10104723
N-[3-(7-methoxynaphthalen-1-yl)propyl]acetamide
CID 10220759
1-[2-(7-methoxynaphthalen-1-yl)ethyl]-3-methylthiourea
CID 19385775
N-[2-(7-methoxynaphthalen-1-yl)ethyl]furan-2-carboxamide
CID 44581533
5-bromo-N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide
CID 19021866

Frequently Asked Questions

What is the IUPAC name of N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide?
The IUPAC name of N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide (CID 57250366) is N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide.
What is the SMILES notation for N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide?
The canonical SMILES for N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide is COc1ccc2cccc(CCNC(=O)C3CNC(=O)N3)c2c1.
What is the InChIKey of N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide?
The InChIKey is JSOWVENVGHFWKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-23-13-6-5-11-3-2-4-12(14(11)9-13)7-8-18-16(21)15-10-19-17(22)20-15/h2-6,9,15H,7-8,10H2,1H3,(H,18,21)(H2,19,20,22).
What are the key properties of N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide?
N-[2-(7-methoxynaphthalen-1-yl)ethyl]-2-oxoimidazolidine-4-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 1.19, 5 rotatable bonds, 3 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-oxoimidazolidine-4-carboxamide is sourced from PubChem (CID 57250366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).