cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide

C17H18N2O2 — CID 42386223

IUPACcis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide
SMILESC[C@H]1C[C@H]1C(=O)NNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C17H18N2O2/c1-11-9-15(11)17(21)19-18-16(20)10-13-7-4-6-12-5-2-3-8-14(12)13/h2-8,11,15H,9-10H2,1H3,(H,18,20)(H,19,21)/t11-,15+/m0/s1
InChIKeyPQKIXDOZWVHQKI-XHDPSFHLSA-N
MW282.34 g/mol
LogP2.19
Rot. Bonds3

About cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide

cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide (PubChem CID 42386223) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide.

Molecular Properties

Compound Namecis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide
PubChem CID42386223
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Namecis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide
SMILESC[C@H]1C[C@H]1C(=O)NNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C17H18N2O2/c1-11-9-15(11)17(21)19-18-16(20)10-13-7-4-6-12-5-2-3-8-14(12)13/h2-8,11,15H,9-10H2,1H3,(H,18,20)(H,19,21)/t11-,15+/m0/s1
InChIKeyPQKIXDOZWVHQKI-XHDPSFHLSA-N
XLogP2.19
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(2-methylcyclopropyl)-2-naphthalen-1-ylethanone
CID 61055472
trimethyl-[(2-naphthalen-1-ylacetyl)amino]azanium
CID 872172
N-(3-methylcyclopentyl)-2-naphthalen-1-ylacetamide
CID 114549688
(3R)-N'-(2-naphthalen-1-ylacetyl)-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide
CID 2426915
N-cyclopropyl-2-naphthalen-1-ylacetamide
CID 976036
2,2,2-trifluoro-N'-(2-naphthalen-1-ylacetyl)acetohydrazide
CID 905420
1-(3,5-dimethylcyclohexyl)-2-naphthalen-1-ylethanone
CID 105105139
2-(4-chlorophenyl)-N'-(2-naphthalen-1-ylacetyl)acetohydrazide
CID 4936833
4-[2-(2-naphthalen-1-ylacetyl)hydrazinyl]-4-oxobutanoate
CID 7948453
1-(3,4-dimethylcyclohexyl)-2-naphthalen-1-ylethanone
CID 105105273
N'-[2-(3-bromo-1-adamantyl)acetyl]-2-naphthalen-1-ylacetohydrazide
CID 75669398
1-(dicyclopropylmethyl)-3-[(2-naphthalen-1-ylacetyl)amino]urea
CID 75415419

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide?
The IUPAC name of cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide (CID 42386223) is cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide.
What is the SMILES notation for cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide?
The canonical SMILES for cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide is C[C@H]1C[C@H]1C(=O)NNC(=O)Cc1cccc2ccccc12.
What is the InChIKey of cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide?
The InChIKey is PQKIXDOZWVHQKI-XHDPSFHLSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-11-9-15(11)17(21)19-18-16(20)10-13-7-4-6-12-5-2-3-8-14(12)13/h2-8,11,15H,9-10H2,1H3,(H,18,20)(H,19,21)/t11-,15+/m0/s1.
What are the key properties of cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide?
cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide has a molecular weight of 282.34 g/mol, XLogP of 2.19, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-methyl-N'-(2-naphthalen-1-ylacetyl)cyclopropane-1-carbohydrazide is sourced from PubChem (CID 42386223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).