1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine

C12H14N6 — CID 79295607

IUPAC1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine
SMILESNc1nc2cnccc2n1CCCn1ccnc1
InChIInChI=1S/C12H14N6/c13-12-16-10-8-14-3-2-11(10)18(12)6-1-5-17-7-4-15-9-17/h2-4,7-9H,1,5-6H2,(H2,13,16)
InChIKeyFWSURQLXASWQBN-UHFFFAOYSA-N
MW242.29 g/mol
LogP1.30
Rot. Bonds4

About 1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine

1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine (PubChem CID 79295607) has the molecular formula C12H14N6 and a molecular weight of 242.29 g/mol. Its IUPAC name is 1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine.

Molecular Properties

Compound Name1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine
PubChem CID79295607
Molecular FormulaC12H14N6
Molecular Weight242.29 g/mol
Exact Mass242.13
IUPAC Name1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine
SMILESNc1nc2cnccc2n1CCCn1ccnc1
InChIInChI=1S/C12H14N6/c13-12-16-10-8-14-3-2-11(10)18(12)6-1-5-17-7-4-15-9-17/h2-4,7-9H,1,5-6H2,(H2,13,16)
InChIKeyFWSURQLXASWQBN-UHFFFAOYSA-N
XLogP1.30
TPSA74.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.29
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(3-methylsulfonylpropyl)imidazo[4,5-c]pyridin-2-amine
CID 79296529
1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine
CID 79295428
3-(4-imidazol-1-ylbutyl)imidazo[4,5-b]pyridin-2-amine
CID 79289839
5-fluoro-1-(2-imidazol-1-ylethyl)benzimidazol-2-amine
CID 54951192
1-(2-pyrrolidin-1-ylethyl)imidazo[4,5-c]pyridin-2-amine
CID 79296073
1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine
CID 114125340
1-(3-imidazol-1-ylpropyl)-2-propylbenzimidazol-5-amine
CID 62508178
1-[2-(5-bromothiophen-2-yl)ethyl]imidazo[4,5-c]pyridin-2-amine
CID 106036159
1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazo[4,5-c]pyridin-2-amine
CID 79296254
1-[2-(dimethylamino)-2-methylpropyl]imidazo[4,5-c]pyridin-2-amine
CID 79295803
6-amino-3-(3-imidazol-1-ylpropyl)-1H-benzimidazol-2-one
CID 110491439
1-[2-(dimethylamino)propyl]imidazo[4,5-c]pyridin-2-amine
CID 79296345

Frequently Asked Questions

What is the IUPAC name of 1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine?
The IUPAC name of 1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine (CID 79295607) is 1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine.
What is the SMILES notation for 1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine?
The canonical SMILES for 1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine is Nc1nc2cnccc2n1CCCn1ccnc1.
What is the InChIKey of 1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine?
The InChIKey is FWSURQLXASWQBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6/c13-12-16-10-8-14-3-2-11(10)18(12)6-1-5-17-7-4-15-9-17/h2-4,7-9H,1,5-6H2,(H2,13,16).
What are the key properties of 1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine?
1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine has a molecular weight of 242.29 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine is sourced from PubChem (CID 79295607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).