1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide

C15H19N3O2 — CID 134795001

IUPAC1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide
SMILESO=C(NCC1CC1)C1CN(Cc2ccccc2)C(=O)N1
InChIInChI=1S/C15H19N3O2/c19-14(16-8-11-6-7-11)13-10-18(15(20)17-13)9-12-4-2-1-3-5-12/h1-5,11,13H,6-10H2,(H,16,19)(H,17,20)
InChIKeyPDOIUEUDLNNAJS-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.11
Rot. Bonds5

About 1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide

1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide (PubChem CID 134795001) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide
PubChem CID134795001
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide
SMILESO=C(NCC1CC1)C1CN(Cc2ccccc2)C(=O)N1
InChIInChI=1S/C15H19N3O2/c19-14(16-8-11-6-7-11)13-10-18(15(20)17-13)9-12-4-2-1-3-5-12/h1-5,11,13H,6-10H2,(H,16,19)(H,17,20)
InChIKeyPDOIUEUDLNNAJS-UHFFFAOYSA-N
XLogP1.11
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide?
The IUPAC name of 1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide (CID 134795001) is 1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide.
What is the SMILES notation for 1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide?
The canonical SMILES for 1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide is O=C(NCC1CC1)C1CN(Cc2ccccc2)C(=O)N1.
What is the InChIKey of 1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide?
The InChIKey is PDOIUEUDLNNAJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c19-14(16-8-11-6-7-11)13-10-18(15(20)17-13)9-12-4-2-1-3-5-12/h1-5,11,13H,6-10H2,(H,16,19)(H,17,20).
What are the key properties of 1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide?
1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 1.11, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(cyclopropylmethyl)-2-oxoimidazolidine-4-carboxamide is sourced from PubChem (CID 134795001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).