5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide

C15H22N2O2 — CID 116845249

IUPAC5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide
SMILESCN(N)C(=O)CCCCc1ccc2c(c1)CCCO2
InChIInChI=1S/C15H22N2O2/c1-17(16)15(18)7-3-2-5-12-8-9-14-13(11-12)6-4-10-19-14/h8-9,11H,2-7,10,16H2,1H3
InChIKeyKLOAFBGRTJKVJP-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.06
Rot. Bonds5

About 5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide

5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide (PubChem CID 116845249) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide.

Molecular Properties

Compound Name5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide
PubChem CID116845249
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide
SMILESCN(N)C(=O)CCCCc1ccc2c(c1)CCCO2
InChIInChI=1S/C15H22N2O2/c1-17(16)15(18)7-3-2-5-12-8-9-14-13(11-12)6-4-10-19-14/h8-9,11H,2-7,10,16H2,1H3
InChIKeyKLOAFBGRTJKVJP-UHFFFAOYSA-N
XLogP2.06
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(3,4-dihydro-2H-chromen-6-yl)-N-methylpropanehydrazide
CID 116844990
5-(3,4-dihydro-2H-chromen-6-yl)-N'-methylpentanehydrazide
CID 116846644
4-(2,3-dihydro-1H-inden-5-yl)-N-methylbutanehydrazide
CID 116845082
4-(3,4-dihydro-2H-chromen-6-yl)-N'-methylbutanehydrazide
CID 116846526
2-amino-3-(3,4-dihydro-2H-chromen-6-yl)-N-methylpropanehydrazide
CID 116849113
2-(3,4-dihydro-2H-chromen-6-yl)ethylurea
CID 115168538
5-(2,3-dihydro-1-benzofuran-5-yl)-1-phenylpentan-1-one
CID 65441462
2-cyano-N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-N-methylacetamide
CID 115173364
5-(3,4-dihydro-2H-chromen-6-yl)pentanenitrile
CID 82471341
N'-(3,4-dihydro-2H-chromen-6-ylmethyl)-N'-methyloxamide
CID 115191993
6-(3,4-dihydro-2H-chromen-6-yl)-N-ethylhexan-1-amine
CID 65306061
N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]butanamide
CID 110790414

Frequently Asked Questions

What is the IUPAC name of 5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide?
The IUPAC name of 5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide (CID 116845249) is 5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide.
What is the SMILES notation for 5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide?
The canonical SMILES for 5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide is CN(N)C(=O)CCCCc1ccc2c(c1)CCCO2.
What is the InChIKey of 5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide?
The InChIKey is KLOAFBGRTJKVJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-17(16)15(18)7-3-2-5-12-8-9-14-13(11-12)6-4-10-19-14/h8-9,11H,2-7,10,16H2,1H3.
What are the key properties of 5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide?
5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide has a molecular weight of 262.35 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,4-dihydro-2H-chromen-6-yl)-N-methylpentanehydrazide is sourced from PubChem (CID 116845249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).