2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide

C10H17N3O3 — CID 15308077

IUPAC2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide
SMILESNC(=O)CNC(=O)CN1CCCCCC1=O
InChIInChI=1S/C10H17N3O3/c11-8(14)6-12-9(15)7-13-5-3-1-2-4-10(13)16/h1-7H2,(H2,11,14)(H,12,15)
InChIKeyNIEMXSCFVRUVIS-UHFFFAOYSA-N
MW227.26 g/mol
LogP-1.01
Rot. Bonds4

About 2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide

2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide (PubChem CID 15308077) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is 2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide.

Molecular Properties

Compound Name2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide
PubChem CID15308077
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC Name2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide
SMILESNC(=O)CNC(=O)CN1CCCCCC1=O
InChIInChI=1S/C10H17N3O3/c11-8(14)6-12-9(15)7-13-5-3-1-2-4-10(13)16/h1-7H2,(H2,11,14)(H,12,15)
InChIKeyNIEMXSCFVRUVIS-UHFFFAOYSA-N
XLogP-1.01
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 5-1.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(2-oxoazocan-1-yl)acetyl]amino]acetic acid
CID 119171385
N-(2-hydroxyethyl)-2-(2-oxoazepan-1-yl)acetamide
CID 43388932
2-(2-oxopiperidin-1-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CID 86984731
2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]-N-propan-2-ylacetamide
CID 3050861
2-[2-[[2-(2-oxoazocan-1-yl)acetyl]amino]ethylsulfanyl]acetic acid
CID 119241925
1,3-bis[(2-oxoazonan-1-yl)methyl]urea
CID 23348617
2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]-N-propylacetamide
CID 56810104
N-[(2-hydroxycyclopentyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide
CID 111471342
N-[2-(cycloheptylamino)ethyl]-2-(2-oxoazocan-1-yl)acetamide;hydrochloride
CID 119621354
2-hydroxy-2-methyl-3-[[2-(2-oxoazepan-1-yl)acetyl]amino]propanoic acid
CID 66173577
4-[[[2-(2-oxoazocan-1-yl)acetyl]amino]methyl]benzoic acid
CID 119165488
2-(2-oxopiperidin-1-yl)-N-propan-2-ylacetamide
CID 110689762

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide?
The IUPAC name of 2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide (CID 15308077) is 2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide.
What is the SMILES notation for 2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide?
The canonical SMILES for 2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide is NC(=O)CNC(=O)CN1CCCCCC1=O.
What is the InChIKey of 2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide?
The InChIKey is NIEMXSCFVRUVIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c11-8(14)6-12-9(15)7-13-5-3-1-2-4-10(13)16/h1-7H2,(H2,11,14)(H,12,15).
What are the key properties of 2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide?
2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide has a molecular weight of 227.26 g/mol, XLogP of -1.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide is sourced from PubChem (CID 15308077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).