4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid

C9H10N4O2 — CID 20619265

IUPAC4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid
SMILESO=C(O)c1cc(NC2=NCCN2)ccn1
InChIInChI=1S/C9H10N4O2/c14-8(15)7-5-6(1-2-10-7)13-9-11-3-4-12-9/h1-2,5H,3-4H2,(H,14,15)(H2,10,11,12,13)
InChIKeyMNLFEWRTJCOBRU-UHFFFAOYSA-N
MW206.21 g/mol
LogP0.15
Rot. Bonds2

About 4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid

4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid (PubChem CID 20619265) has the molecular formula C9H10N4O2 and a molecular weight of 206.21 g/mol. Its IUPAC name is 4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid
PubChem CID20619265
Molecular FormulaC9H10N4O2
Molecular Weight206.21 g/mol
Exact Mass206.08
IUPAC Name4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid
SMILESO=C(O)c1cc(NC2=NCCN2)ccn1
InChIInChI=1S/C9H10N4O2/c14-8(15)7-5-6(1-2-10-7)13-9-11-3-4-12-9/h1-2,5H,3-4H2,(H,14,15)(H2,10,11,12,13)
InChIKeyMNLFEWRTJCOBRU-UHFFFAOYSA-N
XLogP0.15
TPSA86.61 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.21
LogP ≤ 50.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid;ethane
CID 91263534
4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)pyridine-2-carboxylic acid
CID 43143014
ethane;N-phenyl-4,5-dihydro-1H-imidazol-2-amine
CID 90984879
2-[[3-(4,5-dihydro-1H-imidazol-2-ylamino)benzoyl]amino]acetic acid
CID 21306708
4-(pyridin-3-ylamino)pyridine-2-carboxylic acid
CID 43143000
4-(2,4,5-trichloroanilino)pyridine-2-carboxylic acid
CID 43326079
4-(4-pyrrolidin-1-ylanilino)pyridine-2-carboxylic acid
CID 63180412
1-[5-(4,5-dihydro-1H-imidazol-2-ylamino)-2,3-dihydroindol-1-yl]ethanone
CID 15840805
2-chloro-4-(4,5-dihydro-1H-imidazol-2-ylamino)-N-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]benzamide
CID 122189110
1-N,4-N-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]benzene-1,4-dicarboxamide;hydrochloride
CID 44531712
1-[6-(4,5-dihydro-1H-imidazol-2-ylamino)-2,3-dihydroindol-1-yl]ethanone;hydroiodide
CID 45260042
4-(5-chloro-2-fluoroanilino)pyridine-2-carboxylic acid
CID 43438570

Frequently Asked Questions

What is the IUPAC name of 4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid?
The IUPAC name of 4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid (CID 20619265) is 4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid.
What is the SMILES notation for 4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid?
The canonical SMILES for 4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid is O=C(O)c1cc(NC2=NCCN2)ccn1.
What is the InChIKey of 4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid?
The InChIKey is MNLFEWRTJCOBRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2/c14-8(15)7-5-6(1-2-10-7)13-9-11-3-4-12-9/h1-2,5H,3-4H2,(H,14,15)(H2,10,11,12,13).
What are the key properties of 4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid?
4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid has a molecular weight of 206.21 g/mol, XLogP of 0.15, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,5-dihydro-1H-imidazol-2-ylamino)pyridine-2-carboxylic acid is sourced from PubChem (CID 20619265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).