6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile

C11H11N5 — CID 65232033

IUPAC6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile
SMILESN#Cc1cccc(NCCc2cnc[nH]2)n1
InChIInChI=1S/C11H11N5/c12-6-9-2-1-3-11(16-9)14-5-4-10-7-13-8-15-10/h1-3,7-8H,4-5H2,(H,13,15)(H,14,16)
InChIKeyXIMCHZWFFGJXFT-UHFFFAOYSA-N
MW213.24 g/mol
LogP1.33
Rot. Bonds4

About 6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile

6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile (PubChem CID 65232033) has the molecular formula C11H11N5 and a molecular weight of 213.24 g/mol. Its IUPAC name is 6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile
PubChem CID65232033
Molecular FormulaC11H11N5
Molecular Weight213.24 g/mol
Exact Mass213.10
IUPAC Name6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile
SMILESN#Cc1cccc(NCCc2cnc[nH]2)n1
InChIInChI=1S/C11H11N5/c12-6-9-2-1-3-11(16-9)14-5-4-10-7-13-8-15-10/h1-3,7-8H,4-5H2,(H,13,15)(H,14,16)
InChIKeyXIMCHZWFFGJXFT-UHFFFAOYSA-N
XLogP1.33
TPSA77.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(1H-imidazol-5-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine
CID 65232549
6-(3-cyanopropylamino)pyridine-2-carbonitrile
CID 130778540
6-[2-(5-methyl-1,3-thiazol-2-yl)ethylamino]pyridine-2-carbonitrile
CID 133323177
2-[2-(1H-imidazol-5-yl)ethylamino]-5-methylbenzonitrile
CID 107931307
1-(2-cyanophenyl)-N-[2-(1H-imidazol-5-yl)ethyl]methanesulfonamide
CID 65231409
4-[2-(1H-imidazol-5-yl)ethylamino]-2-phenylthieno[2,3-b]pyridine-5-carbonitrile
CID 69255362
6-(aminomethyl)-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpyrimidin-4-amine
CID 56711259
6-(3-methylsulfanylbutylamino)pyridine-2-carbonitrile
CID 115766580
6-(2-pyrrolidin-2-ylethylamino)pyridine-2-carbonitrile
CID 114794421
N-[2-(1H-imidazol-5-yl)ethyl]-6-methoxy-2-methylpyrimidin-4-amine
CID 66326106
6-(pyrimidin-5-ylamino)pyridine-2-carbonitrile
CID 107588709
N-[2-(1H-imidazol-5-yl)ethyl]-2-phenylethanamine
CID 11820597

Frequently Asked Questions

What is the IUPAC name of 6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile?
The IUPAC name of 6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile (CID 65232033) is 6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile.
What is the SMILES notation for 6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile?
The canonical SMILES for 6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile is N#Cc1cccc(NCCc2cnc[nH]2)n1.
What is the InChIKey of 6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile?
The InChIKey is XIMCHZWFFGJXFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5/c12-6-9-2-1-3-11(16-9)14-5-4-10-7-13-8-15-10/h1-3,7-8H,4-5H2,(H,13,15)(H,14,16).
What are the key properties of 6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile?
6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile has a molecular weight of 213.24 g/mol, XLogP of 1.33, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(1H-imidazol-5-yl)ethylamino]pyridine-2-carbonitrile is sourced from PubChem (CID 65232033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).