[4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone

C15H24N4O — CID 74244064

IUPAC[4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone
SMILESCN1CCCCC1C(=O)N1CCC(c2ncc[nH]2)CC1
InChIInChI=1S/C15H24N4O/c1-18-9-3-2-4-13(18)15(20)19-10-5-12(6-11-19)14-16-7-8-17-14/h7-8,12-13H,2-6,9-11H2,1H3,(H,16,17)
InChIKeyCKUGCDUQQNCSNU-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.60
Rot. Bonds2

About [4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone

[4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone (PubChem CID 74244064) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is [4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone.

Molecular Properties

Compound Name[4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone
PubChem CID74244064
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name[4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone
SMILESCN1CCCCC1C(=O)N1CCC(c2ncc[nH]2)CC1
InChIInChI=1S/C15H24N4O/c1-18-9-3-2-4-13(18)15(20)19-10-5-12(6-11-19)14-16-7-8-17-14/h7-8,12-13H,2-6,9-11H2,1H3,(H,16,17)
InChIKeyCKUGCDUQQNCSNU-UHFFFAOYSA-N
XLogP1.60
TPSA52.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone?
The IUPAC name of [4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone (CID 74244064) is [4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone.
What is the SMILES notation for [4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone?
The canonical SMILES for [4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone is CN1CCCCC1C(=O)N1CCC(c2ncc[nH]2)CC1.
What is the InChIKey of [4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone?
The InChIKey is CKUGCDUQQNCSNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-18-9-3-2-4-13(18)15(20)19-10-5-12(6-11-19)14-16-7-8-17-14/h7-8,12-13H,2-6,9-11H2,1H3,(H,16,17).
What are the key properties of [4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone?
[4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone has a molecular weight of 276.38 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1H-imidazol-2-yl)piperidin-1-yl]-(1-methylpiperidin-2-yl)methanone is sourced from PubChem (CID 74244064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).