4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine

C14H16F2N4 — CID 170752757

IUPAC4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine
SMILESFC1(F)CCN(c2ncc(Cc3ccncc3)[nH]2)CC1
InChIInChI=1S/C14H16F2N4/c15-14(16)3-7-20(8-4-14)13-18-10-12(19-13)9-11-1-5-17-6-2-11/h1-2,5-6,10H,3-4,7-9H2,(H,18,19)
InChIKeyGDOQYGSPJMAMNA-UHFFFAOYSA-N
MW278.31 g/mol
LogP2.63
Rot. Bonds3

About 4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine

4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine (PubChem CID 170752757) has the molecular formula C14H16F2N4 and a molecular weight of 278.31 g/mol. Its IUPAC name is 4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine.

Molecular Properties

Compound Name4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine
PubChem CID170752757
Molecular FormulaC14H16F2N4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine
SMILESFC1(F)CCN(c2ncc(Cc3ccncc3)[nH]2)CC1
InChIInChI=1S/C14H16F2N4/c15-14(16)3-7-20(8-4-14)13-18-10-12(19-13)9-11-1-5-17-6-2-11/h1-2,5-6,10H,3-4,7-9H2,(H,18,19)
InChIKeyGDOQYGSPJMAMNA-UHFFFAOYSA-N
XLogP2.63
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,3-difluoropyrrolidin-1-yl)-5-ethyl-1H-imidazole
CID 130706011
4-[[2-[[1-(trifluoromethyl)cyclopropyl]methyl]-1H-imidazol-5-yl]methyl]pyridine
CID 170752744
4-[[2-[(1S)-2,2-dichlorocyclopropyl]-1H-imidazol-5-yl]methyl]pyridine
CID 170752704
4-[[2-(3,3,3-trifluoropropyl)-1H-imidazol-5-yl]methyl]pyridine
CID 167449121
6-(4,4-difluoropiperidin-1-yl)-N-[(4-fluorophenyl)methyl]pyridin-3-amine
CID 155021554
4,4-difluoro-1-(pyridin-4-ylmethyl)cyclohexan-1-amine
CID 66570375
6-(pyridin-4-ylmethyl)-1H-pyrimidin-2-one
CID 67285058
3-[(4,4-difluoropiperidin-1-yl)methyl]pyridine
CID 117007748
5-tert-butyl-2-(4,4-difluoropiperidin-1-yl)pyridine
CID 155742359
4-[[4-(pyridin-4-ylmethyl)phenyl]methyl]pyridine
CID 20646252
2-chloro-4-(4,4-difluoropiperidin-1-yl)pyridine
CID 121204880
4-(1H-pyrazol-5-ylmethyl)pyridine
CID 57052578

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine?
The IUPAC name of 4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine (CID 170752757) is 4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine.
What is the SMILES notation for 4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine?
The canonical SMILES for 4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine is FC1(F)CCN(c2ncc(Cc3ccncc3)[nH]2)CC1.
What is the InChIKey of 4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine?
The InChIKey is GDOQYGSPJMAMNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F2N4/c15-14(16)3-7-20(8-4-14)13-18-10-12(19-13)9-11-1-5-17-6-2-11/h1-2,5-6,10H,3-4,7-9H2,(H,18,19).
What are the key properties of 4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine?
4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine has a molecular weight of 278.31 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(4,4-difluoropiperidin-1-yl)-1H-imidazol-5-yl]methyl]pyridine is sourced from PubChem (CID 170752757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).