2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone

C8H15N3O — CID 71649143

IUPAC2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone
SMILESNCC(=O)N1CCC2(CCN2)C1
InChIInChI=1S/C8H15N3O/c9-5-7(12)11-4-2-8(6-11)1-3-10-8/h10H,1-6,9H2
InChIKeySLUONWZFSMZEFF-UHFFFAOYSA-N
MW169.23 g/mol
LogP-1.09
Rot. Bonds1

About 2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone

2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone (PubChem CID 71649143) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is 2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone.

Molecular Properties

Compound Name2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone
PubChem CID71649143
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone
SMILESNCC(=O)N1CCC2(CCN2)C1
InChIInChI=1S/C8H15N3O/c9-5-7(12)11-4-2-8(6-11)1-3-10-8/h10H,1-6,9H2
InChIKeySLUONWZFSMZEFF-UHFFFAOYSA-N
XLogP-1.09
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 5-1.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-1-(1,7-diazaspiro[3.5]nonan-7-yl)ethanone
CID 71646509
4,7-diazaspiro[2.5]octane-7-carboxylic acid
CID 89157543
2-amino-1-(4,4-dimethylpiperidin-1-yl)ethanone;ethane
CID 142306561
1-(2-aminoacetyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318155
2-amino-1-[8-(aminomethyl)-2-azaspiro[4.5]decan-2-yl]ethanone
CID 71649157
2-(1-tert-butylcyclopropyl)-1-(1,7-diazaspiro[3.5]nonan-7-yl)ethanone
CID 58584510
2-amino-1-[(5R,8R)-8-amino-2-azaspiro[4.4]nonan-2-yl]ethanone
CID 97168946
2-amino-1-[(5R)-6-oxa-2-azaspiro[4.5]decan-2-yl]ethanone
CID 129499564
2-amino-1-(4,4-difluoropiperidin-1-yl)ethanone;propane
CID 142306583
(2R)-2-amino-1-(1,7-diazaspiro[3.5]nonan-7-yl)-3-methylbutan-1-one
CID 97174792
2-amino-1-(3,3,4,4-tetrafluoropyrrolidin-1-yl)ethanone
CID 130681510
(4S)-7-(2-chloroacetyl)-1,7-diazaspiro[3.4]octan-2-one
CID 97166637

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone?
The IUPAC name of 2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone (CID 71649143) is 2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone.
What is the SMILES notation for 2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone?
The canonical SMILES for 2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone is NCC(=O)N1CCC2(CCN2)C1.
What is the InChIKey of 2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone?
The InChIKey is SLUONWZFSMZEFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c9-5-7(12)11-4-2-8(6-11)1-3-10-8/h10H,1-6,9H2.
What are the key properties of 2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone?
2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone has a molecular weight of 169.23 g/mol, XLogP of -1.09, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(1,7-diazaspiro[3.4]octan-7-yl)ethanone is sourced from PubChem (CID 71649143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).