dimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium

C16H20N3O2+ — CID 9417627

IUPACdimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium
SMILESC[NH+](C)CCC(=O)NNC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H19N3O2/c1-19(2)10-9-15(20)17-18-16(21)14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11H,9-10H2,1-2H3,(H,17,20)(H,18,21)/p+1
InChIKeyFEUGOQSLBGNTSJ-UHFFFAOYSA-O
MW286.36 g/mol
LogP0.14
Rot. Bonds4

About dimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium

dimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium (PubChem CID 9417627) has the molecular formula C16H20N3O2+ and a molecular weight of 286.36 g/mol. Its IUPAC name is dimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium.

Molecular Properties

Compound Namedimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium
PubChem CID9417627
Molecular FormulaC16H20N3O2+
Molecular Weight286.36 g/mol
Exact Mass286.16
IUPAC Namedimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium
SMILESC[NH+](C)CCC(=O)NNC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H19N3O2/c1-19(2)10-9-15(20)17-18-16(21)14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11H,9-10H2,1-2H3,(H,17,20)(H,18,21)/p+1
InChIKeyFEUGOQSLBGNTSJ-UHFFFAOYSA-O
XLogP0.14
TPSA62.64 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 50.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(2-methoxyphenoxy)acetyl]naphthalene-2-carbohydrazide
CID 1047417
ethane;naphthalene-2-carbohydrazide
CID 91601372
dimethyl-[3-[2-(3-methylbenzo[g][1]benzofuran-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium
CID 9091198
3-bromo-4-methyl-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide
CID 4509301
N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide
CID 47161001
N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide
CID 31828968
4-methyl-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide
CID 809232
N-propylnaphthalene-2-carboxamide
CID 6624536
N-[(E)-but-2-enyl]naphthalene-2-carboxamide
CID 59644417
1-N',4-N'-bis(4-methoxybenzoyl)butanedihydrazide
CID 3140699
N-[4-(naphthalene-2-carbonylamino)butyl]naphthalene-2-carboxamide
CID 101181857
N'-[2-(5-phenyltetrazol-2-yl)acetyl]naphthalene-2-carbohydrazide
CID 9468291

Frequently Asked Questions

What is the IUPAC name of dimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium?
The IUPAC name of dimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium (CID 9417627) is dimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium.
What is the SMILES notation for dimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium?
The canonical SMILES for dimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium is C[NH+](C)CCC(=O)NNC(=O)c1ccc2ccccc2c1.
What is the InChIKey of dimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium?
The InChIKey is FEUGOQSLBGNTSJ-UHFFFAOYSA-O. The full InChI is InChI=1S/C16H19N3O2/c1-19(2)10-9-15(20)17-18-16(21)14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11H,9-10H2,1-2H3,(H,17,20)(H,18,21)/p+1.
What are the key properties of dimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium?
dimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium has a molecular weight of 286.36 g/mol, XLogP of 0.14, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[3-[2-(naphthalene-2-carbonyl)hydrazinyl]-3-oxopropyl]azanium is sourced from PubChem (CID 9417627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).