6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline

C24H25N5 — CID 97284997

IUPAC6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
SMILESCc1ccc2nccc(N3CCC[C@@H](c4nccn4Cc4ccncc4)C3)c2c1
InChIInChI=1S/C24H25N5/c1-18-4-5-22-21(15-18)23(8-11-26-22)28-13-2-3-20(17-28)24-27-12-14-29(24)16-19-6-9-25-10-7-19/h4-12,14-15,20H,2-3,13,16-17H2,1H3/t20-/m1/s1
InChIKeySBBAXENZPJVIOW-HXUWFJFHSA-N
MW383.50 g/mol
LogP4.57
Rot. Bonds4

About 6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline

6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline (PubChem CID 97284997) has the molecular formula C24H25N5 and a molecular weight of 383.50 g/mol. Its IUPAC name is 6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline.

Molecular Properties

Compound Name6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
PubChem CID97284997
Molecular FormulaC24H25N5
Molecular Weight383.50 g/mol
Exact Mass383.21
IUPAC Name6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
SMILESCc1ccc2nccc(N3CCC[C@@H](c4nccn4Cc4ccncc4)C3)c2c1
InChIInChI=1S/C24H25N5/c1-18-4-5-22-21(15-18)23(8-11-26-22)28-13-2-3-20(17-28)24-27-12-14-29(24)16-19-6-9-25-10-7-19/h4-12,14-15,20H,2-3,13,16-17H2,1H3/t20-/m1/s1
InChIKeySBBAXENZPJVIOW-HXUWFJFHSA-N
XLogP4.57
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.50
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(3S)-3-[1-(pyridin-3-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
CID 97155167
2,4,5-trimethyl-6-[(3S)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidine
CID 97123365
2-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-4-amine
CID 97285685
N,6-dimethyl-2-[3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-4-amine
CID 72905200
2-methyl-4-propyl-6-[(3S)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidine
CID 97282076
2-[(3S)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridine-4-carboxamide
CID 97115819
4-[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
CID 70726995
4-[(3R)-3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
CID 96574055
5-methyl-2-[3-[1-(pyridin-3-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridine
CID 70776652
N,N-dimethyl-2-[2-(1-quinolin-4-ylpiperidin-3-yl)imidazol-1-yl]ethanamine
CID 72863111
2-methylsulfanyl-6-[(3S)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-4-amine
CID 97271296
2-propan-2-yl-6-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridine
CID 97131130

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline?
The IUPAC name of 6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline (CID 97284997) is 6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline.
What is the SMILES notation for 6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline?
The canonical SMILES for 6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline is Cc1ccc2nccc(N3CCC[C@@H](c4nccn4Cc4ccncc4)C3)c2c1.
What is the InChIKey of 6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline?
The InChIKey is SBBAXENZPJVIOW-HXUWFJFHSA-N. The full InChI is InChI=1S/C24H25N5/c1-18-4-5-22-21(15-18)23(8-11-26-22)28-13-2-3-20(17-28)24-27-12-14-29(24)16-19-6-9-25-10-7-19/h4-12,14-15,20H,2-3,13,16-17H2,1H3/t20-/m1/s1.
What are the key properties of 6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline?
6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline has a molecular weight of 383.50 g/mol, XLogP of 4.57, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-[(3R)-3-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline is sourced from PubChem (CID 97284997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).