N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide

C12H22N4O2 — CID 61233382

IUPACN'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide
SMILESCC(=O)NNC(=O)CN(C)C1CC2CCC(C1)N2
InChIInChI=1S/C12H22N4O2/c1-8(17)14-15-12(18)7-16(2)11-5-9-3-4-10(6-11)13-9/h9-11,13H,3-7H2,1-2H3,(H,14,17)(H,15,18)
InChIKeyKBSUDIDXBXNREG-UHFFFAOYSA-N
MW254.33 g/mol
LogP-0.63
Rot. Bonds3

About N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide

N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide (PubChem CID 61233382) has the molecular formula C12H22N4O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide.

Molecular Properties

Compound NameN'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide
PubChem CID61233382
Molecular FormulaC12H22N4O2
Molecular Weight254.33 g/mol
Exact Mass254.17
IUPAC NameN'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide
SMILESCC(=O)NNC(=O)CN(C)C1CC2CCC(C1)N2
InChIInChI=1S/C12H22N4O2/c1-8(17)14-15-12(18)7-16(2)11-5-9-3-4-10(6-11)13-9/h9-11,13H,3-7H2,1-2H3,(H,14,17)(H,15,18)
InChIKeyKBSUDIDXBXNREG-UHFFFAOYSA-N
XLogP-0.63
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 5-0.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-acetyl-2-[azepan-4-yl(methyl)amino]acetohydrazide
CID 107173328
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N-(4-chlorophenyl)acetamide
CID 61231081
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N-(1,1-dioxothiolan-3-yl)acetamide
CID 61232030
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N-benzylacetamide
CID 61230704
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-1-(azocan-1-yl)ethanone
CID 61232607
propan-2-yl 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetate
CID 61231285
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide
CID 61232221
tert-butyl 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetate
CID 61232424
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 61233173
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N-[1-(furan-2-yl)ethyl]acetamide
CID 61231079
methyl 3-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-2,2-dimethylpropanoate
CID 79619644
3-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-2,2-dimethylpropanoic acid
CID 79619645

Frequently Asked Questions

What is the IUPAC name of N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide?
The IUPAC name of N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide (CID 61233382) is N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide.
What is the SMILES notation for N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide?
The canonical SMILES for N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide is CC(=O)NNC(=O)CN(C)C1CC2CCC(C1)N2.
What is the InChIKey of N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide?
The InChIKey is KBSUDIDXBXNREG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2/c1-8(17)14-15-12(18)7-16(2)11-5-9-3-4-10(6-11)13-9/h9-11,13H,3-7H2,1-2H3,(H,14,17)(H,15,18).
What are the key properties of N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide?
N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide has a molecular weight of 254.33 g/mol, XLogP of -0.63, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide is sourced from PubChem (CID 61233382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).