2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide

C18H29N3O — CID 132650229

IUPAC2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide
SMILESCCCC(C(=O)NN)N1c2c(C)cccc2C(C)CC1(C)C
InChIInChI=1S/C18H29N3O/c1-6-8-15(17(22)20-19)21-16-12(2)9-7-10-14(16)13(3)11-18(21,4)5/h7,9-10,13,15H,6,8,11,19H2,1-5H3,(H,20,22)
InChIKeyANXNZWZENJNDDU-UHFFFAOYSA-N
MW303.45 g/mol
LogP3.25
Rot. Bonds4

About 2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide

2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide (PubChem CID 132650229) has the molecular formula C18H29N3O and a molecular weight of 303.45 g/mol. Its IUPAC name is 2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide.

Molecular Properties

Compound Name2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide
PubChem CID132650229
Molecular FormulaC18H29N3O
Molecular Weight303.45 g/mol
Exact Mass303.23
IUPAC Name2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide
SMILESCCCC(C(=O)NN)N1c2c(C)cccc2C(C)CC1(C)C
InChIInChI=1S/C18H29N3O/c1-6-8-15(17(22)20-19)21-16-12(2)9-7-10-14(16)13(3)11-18(21,4)5/h7,9-10,13,15H,6,8,11,19H2,1-5H3,(H,20,22)
InChIKeyANXNZWZENJNDDU-UHFFFAOYSA-N
XLogP3.25
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.45
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl (2S)-2-[(4R)-2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl]hexanoate
CID 125044674
(2R)-2-[(4R)-2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl]hexanoic acid
CID 125044487
2-(2,2,4-trimethyl-3,4-dihydroquinolin-1-yl)butanehydrazide
CID 132649720
2-(8-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl)pentanoic acid
CID 132650285
(2R)-2-[(4R)-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]butanehydrazide
CID 125044444
2-(6-chloro-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl)hexanehydrazide
CID 132651833
(2S)-2-[(4R)-6-chloro-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl]hexanehydrazide
CID 125044610
(2R)-2-[(4R)-8-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl]hexanoic acid
CID 125044518
methyl 2-(6-chloro-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl)pentanoate
CID 132650942
2-(2,6-dimethylphenoxy)pentanehydrazide
CID 54792907
(2S)-2-[(4R)-7-chloro-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl]propanehydrazide
CID 125047320
(2S)-2-[(4R)-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]hexanoic acid
CID 125044403

Frequently Asked Questions

What is the IUPAC name of 2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide?
The IUPAC name of 2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide (CID 132650229) is 2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide.
What is the SMILES notation for 2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide?
The canonical SMILES for 2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide is CCCC(C(=O)NN)N1c2c(C)cccc2C(C)CC1(C)C.
What is the InChIKey of 2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide?
The InChIKey is ANXNZWZENJNDDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O/c1-6-8-15(17(22)20-19)21-16-12(2)9-7-10-14(16)13(3)11-18(21,4)5/h7,9-10,13,15H,6,8,11,19H2,1-5H3,(H,20,22).
What are the key properties of 2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide?
2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide has a molecular weight of 303.45 g/mol, XLogP of 3.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2,4,8-tetramethyl-3,4-dihydroquinolin-1-yl)pentanehydrazide is sourced from PubChem (CID 132650229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).