2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole

C19H23N7 — CID 166380777

IUPAC2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole
SMILESCn1ccc(N2CCN=C2N2CCC(c3nc4ccccc4[nH]3)CC2)n1
InChIInChI=1S/C19H23N7/c1-24-10-8-17(23-24)26-13-9-20-19(26)25-11-6-14(7-12-25)18-21-15-4-2-3-5-16(15)22-18/h2-5,8,10,14H,6-7,9,11-13H2,1H3,(H,21,22)
InChIKeyFCHTWDIMXVCHBG-UHFFFAOYSA-N
MW349.44 g/mol
LogP2.35
Rot. Bonds2

About 2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole

2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole (PubChem CID 166380777) has the molecular formula C19H23N7 and a molecular weight of 349.44 g/mol. Its IUPAC name is 2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole.

Molecular Properties

Compound Name2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole
PubChem CID166380777
Molecular FormulaC19H23N7
Molecular Weight349.44 g/mol
Exact Mass349.20
IUPAC Name2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole
SMILESCn1ccc(N2CCN=C2N2CCC(c3nc4ccccc4[nH]3)CC2)n1
InChIInChI=1S/C19H23N7/c1-24-10-8-17(23-24)26-13-9-20-19(26)25-11-6-14(7-12-25)18-21-15-4-2-3-5-16(15)22-18/h2-5,8,10,14H,6-7,9,11-13H2,1H3,(H,21,22)
InChIKeyFCHTWDIMXVCHBG-UHFFFAOYSA-N
XLogP2.35
TPSA65.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole with MolForge

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Related Compounds

3-(1H-benzimidazol-2-ylamino)-1-(1-methylpyrazol-3-yl)piperidin-2-one
CID 133410505
6-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine
CID 60520703
2-(1-butylpiperidin-4-yl)-1H-benzimidazole
CID 150629700
2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]propan-1-amine
CID 82167745
[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-(1-methylpyrazol-3-yl)methanone
CID 91946785
2-(1-ethylsulfonylpiperidin-4-yl)-1H-benzimidazole
CID 4626342
3-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]propan-1-ol
CID 111112410
2-[1-[(1-methylimidazol-2-yl)methyl]piperidin-4-yl]-1H-benzimidazole
CID 56787398
2-[1-[6-(4-methoxyphenyl)pyridazin-3-yl]piperidin-4-yl]-1H-benzimidazole
CID 108776236
2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-5-methyl-1,3-benzoxazole
CID 127323044
2-[1-[5-(trifluoromethoxy)-2-pyridinyl]piperidin-4-yl]-1H-benzimidazole
CID 133488992
2-[1-(azepan-1-ylsulfonyl)piperidin-4-yl]-1H-benzimidazole
CID 18148631

Frequently Asked Questions

What is the IUPAC name of 2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole?
The IUPAC name of 2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole (CID 166380777) is 2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole.
What is the SMILES notation for 2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole?
The canonical SMILES for 2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole is Cn1ccc(N2CCN=C2N2CCC(c3nc4ccccc4[nH]3)CC2)n1.
What is the InChIKey of 2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole?
The InChIKey is FCHTWDIMXVCHBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N7/c1-24-10-8-17(23-24)26-13-9-20-19(26)25-11-6-14(7-12-25)18-21-15-4-2-3-5-16(15)22-18/h2-5,8,10,14H,6-7,9,11-13H2,1H3,(H,21,22).
What are the key properties of 2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole?
2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole has a molecular weight of 349.44 g/mol, XLogP of 2.35, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[1-(1-methylpyrazol-3-yl)-4,5-dihydroimidazol-2-yl]piperidin-4-yl]-1H-benzimidazole is sourced from PubChem (CID 166380777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).