4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine

C19H22N6 — CID 72930498

IUPAC4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine
SMILESNc1cc(N2CCC(c3nccn3Cc3ccncc3)CC2)ccn1
InChIInChI=1S/C19H22N6/c20-18-13-17(3-8-22-18)24-10-4-16(5-11-24)19-23-9-12-25(19)14-15-1-6-21-7-2-15/h1-3,6-9,12-13,16H,4-5,10-11,14H2,(H2,20,22)
InChIKeyBRBXWUKQXGHOPZ-UHFFFAOYSA-N
MW334.43 g/mol
LogP2.69
Rot. Bonds4

About 4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine

4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine (PubChem CID 72930498) has the molecular formula C19H22N6 and a molecular weight of 334.43 g/mol. Its IUPAC name is 4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine.

Molecular Properties

Compound Name4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine
PubChem CID72930498
Molecular FormulaC19H22N6
Molecular Weight334.43 g/mol
Exact Mass334.19
IUPAC Name4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine
SMILESNc1cc(N2CCC(c3nccn3Cc3ccncc3)CC2)ccn1
InChIInChI=1S/C19H22N6/c20-18-13-17(3-8-22-18)24-10-4-16(5-11-24)19-23-9-12-25(19)14-15-1-6-21-7-2-15/h1-3,6-9,12-13,16H,4-5,10-11,14H2,(H2,20,22)
InChIKeyBRBXWUKQXGHOPZ-UHFFFAOYSA-N
XLogP2.69
TPSA72.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.43
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-4-amine
CID 97285685
6-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridine-3-carbonitrile
CID 72852375
2-[4-[1-(pyridin-3-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-4-amine
CID 72933428
2,6-dimethyl-4-[4-[1-(pyridin-3-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridine
CID 70721028
[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]methanone;dihydrochloride
CID 154899926
4-(4-fluoropiperidin-1-yl)pyridin-2-amine
CID 164659406
2-cyclopentyl-1-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]ethanone
CID 72915173
5-phenyl-3-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]-1,2,4-oxadiazole
CID 72839692
2-methylsulfanyl-6-[(3S)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-4-amine
CID 97271296
[(1S,3R)-3-aminocyclopentyl]-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]methanone
CID 72876467
N-cyclohexyl-4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidine-1-carboxamide
CID 72900440
2-[(3S)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridine-4-carboxamide
CID 97115819

Frequently Asked Questions

What is the IUPAC name of 4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine?
The IUPAC name of 4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine (CID 72930498) is 4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine.
What is the SMILES notation for 4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine?
The canonical SMILES for 4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine is Nc1cc(N2CCC(c3nccn3Cc3ccncc3)CC2)ccn1.
What is the InChIKey of 4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine?
The InChIKey is BRBXWUKQXGHOPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6/c20-18-13-17(3-8-22-18)24-10-4-16(5-11-24)19-23-9-12-25(19)14-15-1-6-21-7-2-15/h1-3,6-9,12-13,16H,4-5,10-11,14H2,(H2,20,22).
What are the key properties of 4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine?
4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine has a molecular weight of 334.43 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridin-2-amine is sourced from PubChem (CID 72930498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).