N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide

C14H14N4O — CID 89362033

IUPACN-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide
SMILES[3H]CC(=O)Nc1nc2ccccc2c2c1nc(C)n2C
InChIInChI=1S/C14H14N4O/c1-8-15-12-13(18(8)3)10-6-4-5-7-11(10)17-14(12)16-9(2)19/h4-7H,1-3H3,(H,16,17,19)/i2T
InChIKeyVMWHWONDWYWGHH-FUPOQFPWSA-N
MW256.30 g/mol
LogP2.39
Rot. Bonds2

About N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide

N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide (PubChem CID 89362033) has the molecular formula C14H14N4O and a molecular weight of 256.30 g/mol. Its IUPAC name is N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide.

Molecular Properties

Compound NameN-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide
PubChem CID89362033
Molecular FormulaC14H14N4O
Molecular Weight256.30 g/mol
Exact Mass256.12
IUPAC NameN-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide
SMILES[3H]CC(=O)Nc1nc2ccccc2c2c1nc(C)n2C
InChIInChI=1S/C14H14N4O/c1-8-15-12-13(18(8)3)10-6-4-5-7-11(10)17-14(12)16-9(2)19/h4-7H,1-3H3,(H,16,17,19)/i2T
InChIKeyVMWHWONDWYWGHH-FUPOQFPWSA-N
XLogP2.39
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide 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

N-(2-methylquinazolin-4-yl)acetamide
CID 13329017
[2,3-bis(carboxyamino)quinolin-4-yl]carbamic acid
CID 141043528
4-chloro-N,1-dimethylimidazo[4,5-c]quinolin-2-amine
CID 86227601
2,2-dimethyl-N-[2-[[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]amino]-2-oxoethyl]propanamide
CID 162785225
2-hydroxypropane-1,2,3-tricarboxylic acid;2-(methylamino)-N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]acetamide
CID 46175201
1,2-dimethylchromeno[3,4-d]imidazol-4-one
CID 773639
1,2-dimethyl-5H-imidazo[4,5-c]quinolin-4-one
CID 10059064
N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]heptanamide
CID 162361130
2-[2-[ethyl(methyl)amino]-2-oxoethoxy]-N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]acetamide
CID 163665582
benzyl N-[1-(2-prop-1-ynoxyethyl)imidazo[4,5-c]quinolin-4-yl]carbamate
CID 22254451
2,3-dimethylquinoline-4-carbonyl chloride
CID 59105963
N-[4-(4-amino-2-methylimidazo[4,5-c]quinolin-1-yl)butyl]-2-methylpropanamide
CID 23512692

Frequently Asked Questions

What is the IUPAC name of N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide?
The IUPAC name of N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide (CID 89362033) is N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide.
What is the SMILES notation for N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide?
The canonical SMILES for N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide is [3H]CC(=O)Nc1nc2ccccc2c2c1nc(C)n2C.
What is the InChIKey of N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide?
The InChIKey is VMWHWONDWYWGHH-FUPOQFPWSA-N. The full InChI is InChI=1S/C14H14N4O/c1-8-15-12-13(18(8)3)10-6-4-5-7-11(10)17-14(12)16-9(2)19/h4-7H,1-3H3,(H,16,17,19)/i2T.
What are the key properties of N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide?
N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide has a molecular weight of 256.30 g/mol, XLogP of 2.39, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-dimethylimidazo[4,5-c]quinolin-4-yl)-2-tritioacetamide is sourced from PubChem (CID 89362033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).