(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid

C19H19N3O3 — CID 138557915

IUPAC(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid
SMILESCOc1c(C)cnc(CN(C(=O)O)c2cccc3ncccc23)c1C
InChIInChI=1S/C19H19N3O3/c1-12-10-21-16(13(2)18(12)25-3)11-22(19(23)24)17-8-4-7-15-14(17)6-5-9-20-15/h4-10H,11H2,1-3H3,(H,23,24)
InChIKeyKOXJZFNWPBUQDH-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.94
Rot. Bonds4

About (4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid

(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid (PubChem CID 138557915) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is (4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid.

Molecular Properties

Compound Name(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid
PubChem CID138557915
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid
SMILESCOc1c(C)cnc(CN(C(=O)O)c2cccc3ncccc23)c1C
InChIInChI=1S/C19H19N3O3/c1-12-10-21-16(13(2)18(12)25-3)11-22(19(23)24)17-8-4-7-15-14(17)6-5-9-20-15/h4-10H,11H2,1-3H3,(H,23,24)
InChIKeyKOXJZFNWPBUQDH-UHFFFAOYSA-N
XLogP3.94
TPSA75.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid 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

(4-fluorophenyl)-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]carbamic acid
CID 138557800
(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-naphthalen-2-ylcarbamic acid
CID 138557708
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylpyridine-2-carboxamide
CID 47086432
[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methylphenyl]-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]carbamic acid
CID 138557955
3-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]-2-methylpropanoic acid
CID 55007839
2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-(2-methylpropyl)amino]acetic acid
CID 63065383
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-(2-methoxyethoxy)pyridine-3-carboxamide
CID 47087995
4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-propan-2-ylamino]butanoic acid
CID 60833618
3,4,5-trimethoxy-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylbenzamide
CID 51128958
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)butan-2-one
CID 62620221
2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylamino]-N,N-dimethylacetamide
CID 43310961
1-amino-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)-1-phenylpropan-2-one
CID 116551277

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid?
The IUPAC name of (4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid (CID 138557915) is (4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid.
What is the SMILES notation for (4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid?
The canonical SMILES for (4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid is COc1c(C)cnc(CN(C(=O)O)c2cccc3ncccc23)c1C.
What is the InChIKey of (4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid?
The InChIKey is KOXJZFNWPBUQDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-12-10-21-16(13(2)18(12)25-3)11-22(19(23)24)17-8-4-7-15-14(17)6-5-9-20-15/h4-10H,11H2,1-3H3,(H,23,24).
What are the key properties of (4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid?
(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid has a molecular weight of 337.38 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-quinolin-5-ylcarbamic acid is sourced from PubChem (CID 138557915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).