1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid

C10H15N3O2 — CID 175165535

IUPAC1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid
SMILESCCn1c(C(=O)O)nc2c1CCN(C)C2
InChIInChI=1S/C10H15N3O2/c1-3-13-8-4-5-12(2)6-7(8)11-9(13)10(14)15/h3-6H2,1-2H3,(H,14,15)
InChIKeyRCTVLJWXTRRGNJ-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.59
Rot. Bonds2

About 1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid

1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid (PubChem CID 175165535) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid
PubChem CID175165535
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid
SMILESCCn1c(C(=O)O)nc2c1CCN(C)C2
InChIInChI=1S/C10H15N3O2/c1-3-13-8-4-5-12(2)6-7(8)11-9(13)10(14)15/h3-6H2,1-2H3,(H,14,15)
InChIKeyRCTVLJWXTRRGNJ-UHFFFAOYSA-N
XLogP0.59
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,5-diethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide
CID 175877860
(5-methyl-1-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl)-pyrrolidin-1-ylmethanone;2,2,2-trifluoroacetic acid
CID 118742570
2-[(2,7-dimethyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)amino]acetic acid
CID 83842195
N-[2-chloro-3-[2-chloro-3-[5-[[3-(hydroxymethyl)azetidin-1-yl]methyl]-4-methoxypyrimidin-2-yl]phenyl]phenyl]-1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide
CID 156575564
2-ethyl-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carboxylic acid
CID 116532966
6-methyl-2-oxo-1-propyl-7,8-dihydro-5H-1,6-naphthyridine-3-carboxylic acid
CID 82522043
6-methyl-2-propyl-7,8-dihydro-5H-1,6-naphthyridine-3-carboxylic acid
CID 116533203
5-benzyl-N-ethyl-1-methyl-N-propyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide
CID 97442624
2-[2-[[3-[2-chloro-3-[(1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carbonyl)amino]phenyl]-2-methylphenyl]carbamoyl]-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl]acetic acid
CID 135146602
1-ethyl-6-methyl-3-(methylaminomethyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one
CID 82522073
5-methyl-1-(2-methylpropyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 176983612
1-(5-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-1-yl)ethanone
CID 141368938

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid?
The IUPAC name of 1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid (CID 175165535) is 1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid.
What is the SMILES notation for 1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid?
The canonical SMILES for 1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid is CCn1c(C(=O)O)nc2c1CCN(C)C2.
What is the InChIKey of 1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid?
The InChIKey is RCTVLJWXTRRGNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-3-13-8-4-5-12(2)6-7(8)11-9(13)10(14)15/h3-6H2,1-2H3,(H,14,15).
What are the key properties of 1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid?
1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid has a molecular weight of 209.25 g/mol, XLogP of 0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxylic acid is sourced from PubChem (CID 175165535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).