2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide

C18H29N3 — CID 106711911

IUPAC2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCCN1c2ccccc2CCC1C
InChIInChI=1S/C18H29N3/c1-14-10-11-15-8-4-5-9-16(15)21(14)13-7-6-12-18(2,3)17(19)20/h4-5,8-9,14H,6-7,10-13H2,1-3H3,(H3,19,20)
InChIKeySBQPNPBDCQVBMN-UHFFFAOYSA-N
MW287.45 g/mol
LogP3.96
Rot. Bonds6

About 2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide

2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide (PubChem CID 106711911) has the molecular formula C18H29N3 and a molecular weight of 287.45 g/mol. Its IUPAC name is 2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide.

Molecular Properties

Compound Name2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide
PubChem CID106711911
Molecular FormulaC18H29N3
Molecular Weight287.45 g/mol
Exact Mass287.24
IUPAC Name2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCCN1c2ccccc2CCC1C
InChIInChI=1S/C18H29N3/c1-14-10-11-15-8-4-5-9-16(15)21(14)13-7-6-12-18(2,3)17(19)20/h4-5,8-9,14H,6-7,10-13H2,1-3H3,(H3,19,20)
InChIKeySBQPNPBDCQVBMN-UHFFFAOYSA-N
XLogP3.96
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide?
The IUPAC name of 2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide (CID 106711911) is 2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide.
What is the SMILES notation for 2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide?
The canonical SMILES for 2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide is [H]/N=C(\N)C(C)(C)CCCCN1c2ccccc2CCC1C.
What is the InChIKey of 2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide?
The InChIKey is SBQPNPBDCQVBMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3/c1-14-10-11-15-8-4-5-9-16(15)21(14)13-7-6-12-18(2,3)17(19)20/h4-5,8-9,14H,6-7,10-13H2,1-3H3,(H3,19,20).
What are the key properties of 2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide?
2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide has a molecular weight of 287.45 g/mol, XLogP of 3.96, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)hexanimidamide is sourced from PubChem (CID 106711911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).