2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide

C13H19N3O — CID 116849328

IUPAC2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide
SMILESCNNC(=O)C(N)c1ccc2c(c1)CCCC2
InChIInChI=1S/C13H19N3O/c1-15-16-13(17)12(14)11-7-6-9-4-2-3-5-10(9)8-11/h6-8,12,15H,2-5,14H2,1H3,(H,16,17)
InChIKeyQHOJFZMIBIAZBT-UHFFFAOYSA-N
MW233.32 g/mol
LogP0.82
Rot. Bonds3

About 2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide

2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide (PubChem CID 116849328) has the molecular formula C13H19N3O and a molecular weight of 233.32 g/mol. Its IUPAC name is 2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide.

Molecular Properties

Compound Name2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide
PubChem CID116849328
Molecular FormulaC13H19N3O
Molecular Weight233.32 g/mol
Exact Mass233.15
IUPAC Name2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide
SMILESCNNC(=O)C(N)c1ccc2c(c1)CCCC2
InChIInChI=1S/C13H19N3O/c1-15-16-13(17)12(14)11-7-6-9-4-2-3-5-10(9)8-11/h6-8,12,15H,2-5,14H2,1H3,(H,16,17)
InChIKeyQHOJFZMIBIAZBT-UHFFFAOYSA-N
XLogP0.82
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 50.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-2-(3,4-dihydro-2H-chromen-6-yl)-N'-methylacetohydrazide
CID 116849405
(2R)-2-amino-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]propanamide
CID 54995740
2-(methylamino)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 116961596
3-amino-2,2-dimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)propanoic acid
CID 116937900
N,N'-dimethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanediamine
CID 116954289
2-amino-2-(6-methoxynaphthalen-2-yl)-N'-methylacetohydrazide
CID 116849464
(2S,3S)-2-amino-3-methyl-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]pentanamide
CID 61180622
3-amino-3-(5,6,7,8-tetrahydronaphthalen-2-yl)propanamide
CID 116850923
3-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid
CID 20556031
2-(5,6,7,8-tetrahydronaphthalen-2-yl)propanoyl chloride
CID 117047620
1-(methylamino)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-ol
CID 116859383
(2S)-N-carbamoyl-2-[[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]amino]propanamide
CID 8859207

Frequently Asked Questions

What is the IUPAC name of 2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide?
The IUPAC name of 2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide (CID 116849328) is 2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide.
What is the SMILES notation for 2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide?
The canonical SMILES for 2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide is CNNC(=O)C(N)c1ccc2c(c1)CCCC2.
What is the InChIKey of 2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide?
The InChIKey is QHOJFZMIBIAZBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-15-16-13(17)12(14)11-7-6-9-4-2-3-5-10(9)8-11/h6-8,12,15H,2-5,14H2,1H3,(H,16,17).
What are the key properties of 2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide?
2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide has a molecular weight of 233.32 g/mol, XLogP of 0.82, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N'-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetohydrazide is sourced from PubChem (CID 116849328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).