2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide

C16H23N3O2 — CID 60939851

IUPAC2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide
SMILESCC(C1CC1)N(Cc1ccccc1)C(=O)CNC(=O)CN
InChIInChI=1S/C16H23N3O2/c1-12(14-7-8-14)19(11-13-5-3-2-4-6-13)16(21)10-18-15(20)9-17/h2-6,12,14H,7-11,17H2,1H3,(H,18,20)
InChIKeyTXNKDXMKUVKCHI-UHFFFAOYSA-N
MW289.38 g/mol
LogP0.89
Rot. Bonds7

About 2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide

2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide (PubChem CID 60939851) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide
PubChem CID60939851
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide
SMILESCC(C1CC1)N(Cc1ccccc1)C(=O)CNC(=O)CN
InChIInChI=1S/C16H23N3O2/c1-12(14-7-8-14)19(11-13-5-3-2-4-6-13)16(21)10-18-15(20)9-17/h2-6,12,14H,7-11,17H2,1H3,(H,18,20)
InChIKeyTXNKDXMKUVKCHI-UHFFFAOYSA-N
XLogP0.89
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide?
The IUPAC name of 2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide (CID 60939851) is 2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide is CC(C1CC1)N(Cc1ccccc1)C(=O)CNC(=O)CN.
What is the InChIKey of 2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide?
The InChIKey is TXNKDXMKUVKCHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-12(14-7-8-14)19(11-13-5-3-2-4-6-13)16(21)10-18-15(20)9-17/h2-6,12,14H,7-11,17H2,1H3,(H,18,20).
What are the key properties of 2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide?
2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide has a molecular weight of 289.38 g/mol, XLogP of 0.89, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide is sourced from PubChem (CID 60939851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).