(6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine

C9H11ClN2O — CID 53403029

IUPAC(6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine
SMILESNNC1CCOc2ccc(Cl)cc21
InChIInChI=1S/C9H11ClN2O/c10-6-1-2-9-7(5-6)8(12-11)3-4-13-9/h1-2,5,8,12H,3-4,11H2
InChIKeyUBEXSJZWLUUARV-UHFFFAOYSA-N
MW198.65 g/mol
LogP1.63
Rot. Bonds1

About (6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine

(6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine (PubChem CID 53403029) has the molecular formula C9H11ClN2O and a molecular weight of 198.65 g/mol. Its IUPAC name is (6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine.

Molecular Properties

Compound Name(6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine
PubChem CID53403029
Molecular FormulaC9H11ClN2O
Molecular Weight198.65 g/mol
Exact Mass198.06
IUPAC Name(6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine
SMILESNNC1CCOc2ccc(Cl)cc21
InChIInChI=1S/C9H11ClN2O/c10-6-1-2-9-7(5-6)8(12-11)3-4-13-9/h1-2,5,8,12H,3-4,11H2
InChIKeyUBEXSJZWLUUARV-UHFFFAOYSA-N
XLogP1.63
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.65
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-N-(6-chloro-3,4-dihydro-2H-chromen-4-yl)benzamide
CID 108764686
N-benzyl-6-chloro-3,4-dihydro-2H-chromen-4-amine
CID 12851989
(R)-N-[(4R)-6-chloro-3,4-dihydro-2H-chromen-4-yl]-2-methylpropane-2-sulfinamide
CID 155789629
6-chloro-3,4-dihydro-2H-chromen-4-ol
CID 15148408
2-chloro-N-(6-chloro-3,4-dihydro-2H-chromen-4-yl)propanamide
CID 108742262
2-(6-chloro-3,4-dihydro-2H-chromen-4-yl)ethanamine
CID 82078156
3-(6-chloro-3,4-dihydro-2H-chromen-4-yl)-1,1-diethylurea
CID 108742260
N-(6-chloro-3,4-dihydro-2H-chromen-4-yl)-4-methylbenzenesulfonamide
CID 108783097
3,4-dichloro-N-(6-chloro-3,4-dihydro-2H-chromen-4-yl)benzamide
CID 108764672
1-(6-chloro-3,4-dihydro-2H-chromen-4-yl)ethanamine
CID 83909719
N-(7-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)formamide
CID 110477139
[(1R)-6-chloro-2,3-dihydro-1H-inden-1-yl]hydrazine
CID 124537604

Frequently Asked Questions

What is the IUPAC name of (6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine?
The IUPAC name of (6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine (CID 53403029) is (6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine.
What is the SMILES notation for (6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine?
The canonical SMILES for (6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine is NNC1CCOc2ccc(Cl)cc21.
What is the InChIKey of (6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine?
The InChIKey is UBEXSJZWLUUARV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2O/c10-6-1-2-9-7(5-6)8(12-11)3-4-13-9/h1-2,5,8,12H,3-4,11H2.
What are the key properties of (6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine?
(6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine has a molecular weight of 198.65 g/mol, XLogP of 1.63, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-3,4-dihydro-2H-chromen-4-yl)hydrazine is sourced from PubChem (CID 53403029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).