1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone

C19H26N4O2 — CID 70711639

IUPAC1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone
SMILESCc1cccc2[nH]c(C3CCN(C(=O)CC4CNCCO4)CC3)nc12
InChIInChI=1S/C19H26N4O2/c1-13-3-2-4-16-18(13)22-19(21-16)14-5-8-23(9-6-14)17(24)11-15-12-20-7-10-25-15/h2-4,14-15,20H,5-12H2,1H3,(H,21,22)
InChIKeyRRRLRCUCYZOMPN-UHFFFAOYSA-N
MW342.44 g/mol
LogP1.96
Rot. Bonds3

About 1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone

1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone (PubChem CID 70711639) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is 1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone.

Molecular Properties

Compound Name1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone
PubChem CID70711639
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC Name1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone
SMILESCc1cccc2[nH]c(C3CCN(C(=O)CC4CNCCO4)CC3)nc12
InChIInChI=1S/C19H26N4O2/c1-13-3-2-4-16-18(13)22-19(21-16)14-5-8-23(9-6-14)17(24)11-15-12-20-7-10-25-15/h2-4,14-15,20H,5-12H2,1H3,(H,21,22)
InChIKeyRRRLRCUCYZOMPN-UHFFFAOYSA-N
XLogP1.96
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-pyrrolidin-1-ylethanone
CID 70746403
2-(3-hydroxypiperidin-1-yl)-1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]ethanone
CID 72907509
1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-morpholin-2-ylethanone
CID 119828406
1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-pyridin-3-yloxyethanone
CID 56753993
4-methyl-2-piperidin-4-yl-1H-benzimidazole
CID 18761517
[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-(6-methyl-3-pyridinyl)methanone
CID 70730737
[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-(5-methyl-1H-pyrazol-3-yl)methanone
CID 72907250
[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-(5-methylpyrazin-2-yl)methanone
CID 70768059
2-hydroxy-1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-4-methylsulfanylbutan-1-one
CID 72931914
[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-(2-methylsulfanylpyrimidin-5-yl)methanone
CID 70734781
1-[4-(2-chlorophenoxy)piperidin-1-yl]-2-morpholin-2-ylethanone
CID 70786895
2-(methylamino)-1-[3-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]ethanone
CID 56875048

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone?
The IUPAC name of 1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone (CID 70711639) is 1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone.
What is the SMILES notation for 1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone?
The canonical SMILES for 1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone is Cc1cccc2[nH]c(C3CCN(C(=O)CC4CNCCO4)CC3)nc12.
What is the InChIKey of 1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone?
The InChIKey is RRRLRCUCYZOMPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-13-3-2-4-16-18(13)22-19(21-16)14-5-8-23(9-6-14)17(24)11-15-12-20-7-10-25-15/h2-4,14-15,20H,5-12H2,1H3,(H,21,22).
What are the key properties of 1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone?
1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone has a molecular weight of 342.44 g/mol, XLogP of 1.96, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-2-morpholin-2-ylethanone is sourced from PubChem (CID 70711639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).