2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide

C19H20N2O2 — CID 171487218

IUPAC2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide
SMILESCc1ccccc1NNC(=O)c1ccc2c(c1)C=CC(C)(C)O2
InChIInChI=1S/C19H20N2O2/c1-13-6-4-5-7-16(13)20-21-18(22)15-8-9-17-14(12-15)10-11-19(2,3)23-17/h4-12,20H,1-3H3,(H,21,22)
InChIKeyYZISAYOKJHCLPO-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.94
Rot. Bonds3

About 2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide

2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide (PubChem CID 171487218) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide.

Molecular Properties

Compound Name2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide
PubChem CID171487218
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide
SMILESCc1ccccc1NNC(=O)c1ccc2c(c1)C=CC(C)(C)O2
InChIInChI=1S/C19H20N2O2/c1-13-6-4-5-7-16(13)20-21-18(22)15-8-9-17-14(12-15)10-11-19(2,3)23-17/h4-12,20H,1-3H3,(H,21,22)
InChIKeyYZISAYOKJHCLPO-UHFFFAOYSA-N
XLogP3.94
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-chloro-3-fluorophenyl)-2,2-dimethylchromene-6-carbohydrazide
CID 171487223
N'-(2,4-difluorophenyl)-2,2-dimethylchromene-6-carbohydrazide
CID 171487215
N-(3,4-dimethylphenyl)-2,2-dimethylchromene-6-carboxamide
CID 118199582
N-(3-methoxy-4-methylphenyl)-2,2-dimethylchromene-6-carboxamide
CID 118199635
N-[(3-methoxy-4-methylphenyl)methyl]-2,2-dimethylchromene-6-carboxamide
CID 118199581
2-phenyl-N-(2,2,7-trimethylchromen-6-yl)propanamide
CID 54176266
(2S)-1-(2,2-dimethylchromen-6-yl)-2-(3-methoxy-4-methylphenyl)propan-1-one
CID 118199584
1-(1,3-benzodioxole-5-carbonylamino)-3-(2-methylphenyl)thiourea
CID 5169970
3-benzyl-3-methyl-N-(2-methylphenyl)-2H-1-benzofuran-5-carboxamide;ethane
CID 142619516
(E)-3-(2,2-dimethylchromen-6-yl)prop-2-enoic acid
CID 10513634
[[amino-(2,2-dimethylchromen-6-yl)methylidene]amino] thiophene-2-carboxylate
CID 2821697
2,2-dimethyl-6-methylsulfonylchromene
CID 14210386

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide?
The IUPAC name of 2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide (CID 171487218) is 2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide.
What is the SMILES notation for 2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide?
The canonical SMILES for 2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide is Cc1ccccc1NNC(=O)c1ccc2c(c1)C=CC(C)(C)O2.
What is the InChIKey of 2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide?
The InChIKey is YZISAYOKJHCLPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-13-6-4-5-7-16(13)20-21-18(22)15-8-9-17-14(12-15)10-11-19(2,3)23-17/h4-12,20H,1-3H3,(H,21,22).
What are the key properties of 2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide?
2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide has a molecular weight of 308.38 g/mol, XLogP of 3.94, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N'-(2-methylphenyl)chromene-6-carbohydrazide is sourced from PubChem (CID 171487218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).