N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide

C12H22N4O2 — CID 146624355

IUPACN-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide
SMILESCNCC(=O)N1CC2(CCN(C(=O)NC)CC2)C1
InChIInChI=1S/C12H22N4O2/c1-13-7-10(17)16-8-12(9-16)3-5-15(6-4-12)11(18)14-2/h13H,3-9H2,1-2H3,(H,14,18)
InChIKeyLBSRAYDXSQEHAT-UHFFFAOYSA-N
MW254.33 g/mol
LogP-0.53
Rot. Bonds2

About N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide

N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide (PubChem CID 146624355) has the molecular formula C12H22N4O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide.

Molecular Properties

Compound NameN-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide
PubChem CID146624355
Molecular FormulaC12H22N4O2
Molecular Weight254.33 g/mol
Exact Mass254.17
IUPAC NameN-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide
SMILESCNCC(=O)N1CC2(CCN(C(=O)NC)CC2)C1
InChIInChI=1S/C12H22N4O2/c1-13-7-10(17)16-8-12(9-16)3-5-15(6-4-12)11(18)14-2/h13H,3-9H2,1-2H3,(H,14,18)
InChIKeyLBSRAYDXSQEHAT-UHFFFAOYSA-N
XLogP-0.53
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 5-0.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(7-ethyl-2,7-diazaspiro[3.5]nonan-2-yl)-2-(methylamino)ethanone
CID 164556916
1-(6-azaspiro[2.5]octan-6-yl)-2-(methylamino)ethanone
CID 131089762
1-(6-azaspiro[2.5]octan-6-yl)-2-(methylamino)ethanone;hydrochloride
CID 131089761
1-[7-(dimethylaminosulfanyl)-2,7-diazaspiro[3.5]nonan-2-yl]-2-(methylamino)ethanone
CID 166894989
2-(2-methoxyprop-2-enoyl)-N-methyl-2,7-diazaspiro[3.5]nonane-7-carboxamide
CID 170011341
N-methyl-3,9-diazaspiro[5.5]undecane-3-carboxamide
CID 155067147
4-methyl-1-[2-(methylamino)acetyl]piperidine-4-carboxylic acid
CID 63123860
3,3-diethyl-N-methylpyrrolidine-1-carboxamide
CID 115686572
1-[3-hydroxy-3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]-2-(methylamino)ethanone
CID 110108874
N,4,4-trimethylpiperazin-4-ium-1-carboxamide
CID 20728475
1-[7-(2-methylpropyl)-2,7-diazaspiro[3.5]nonan-2-yl]-2-(propan-2-ylamino)ethanone
CID 155404886
10-[2-(methylamino)acetyl]-3,10-diazadispiro[4.1.57.15]tridecan-2-one
CID 146625811

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide?
The IUPAC name of N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide (CID 146624355) is N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide.
What is the SMILES notation for N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide?
The canonical SMILES for N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide is CNCC(=O)N1CC2(CCN(C(=O)NC)CC2)C1.
What is the InChIKey of N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide?
The InChIKey is LBSRAYDXSQEHAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2/c1-13-7-10(17)16-8-12(9-16)3-5-15(6-4-12)11(18)14-2/h13H,3-9H2,1-2H3,(H,14,18).
What are the key properties of N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide?
N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide has a molecular weight of 254.33 g/mol, XLogP of -0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide is sourced from PubChem (CID 146624355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).