N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide

C16H23N3O3 — CID 134796167

IUPACN-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide
SMILESCOc1ccc(CCNC(=O)C2CN(C(C)C)C(=O)N2)cc1
InChIInChI=1S/C16H23N3O3/c1-11(2)19-10-14(18-16(19)21)15(20)17-9-8-12-4-6-13(22-3)7-5-12/h4-7,11,14H,8-10H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyUFVZMIKNUAHZSH-UHFFFAOYSA-N
MW305.38 g/mol
LogP1.16
Rot. Bonds6

About N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide

N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide (PubChem CID 134796167) has the molecular formula C16H23N3O3 and a molecular weight of 305.38 g/mol. Its IUPAC name is N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide
PubChem CID134796167
Molecular FormulaC16H23N3O3
Molecular Weight305.38 g/mol
Exact Mass305.17
IUPAC NameN-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide
SMILESCOc1ccc(CCNC(=O)C2CN(C(C)C)C(=O)N2)cc1
InChIInChI=1S/C16H23N3O3/c1-11(2)19-10-14(18-16(19)21)15(20)17-9-8-12-4-6-13(22-3)7-5-12/h4-7,11,14H,8-10H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyUFVZMIKNUAHZSH-UHFFFAOYSA-N
XLogP1.16
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide?
The IUPAC name of N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide (CID 134796167) is N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide.
What is the SMILES notation for N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide?
The canonical SMILES for N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide is COc1ccc(CCNC(=O)C2CN(C(C)C)C(=O)N2)cc1.
What is the InChIKey of N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide?
The InChIKey is UFVZMIKNUAHZSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3/c1-11(2)19-10-14(18-16(19)21)15(20)17-9-8-12-4-6-13(22-3)7-5-12/h4-7,11,14H,8-10H2,1-3H3,(H,17,20)(H,18,21).
What are the key properties of N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide?
N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 1.16, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide is sourced from PubChem (CID 134796167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).