(3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone

C18H23N5O2 — CID 56801172

IUPAC(3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone
SMILESO=C(c1ccc(N2CCOCC2)nc1)N1CCCC(n2ccnc2)C1
InChIInChI=1S/C18H23N5O2/c24-18(22-6-1-2-16(13-22)23-7-5-19-14-23)15-3-4-17(20-12-15)21-8-10-25-11-9-21/h3-5,7,12,14,16H,1-2,6,8-11,13H2
InChIKeyYCOPSBYJHXOKGD-UHFFFAOYSA-N
MW341.42 g/mol
LogP1.59
Rot. Bonds3

About (3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone

(3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone (PubChem CID 56801172) has the molecular formula C18H23N5O2 and a molecular weight of 341.42 g/mol. Its IUPAC name is (3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone.

Molecular Properties

Compound Name(3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone
PubChem CID56801172
Molecular FormulaC18H23N5O2
Molecular Weight341.42 g/mol
Exact Mass341.19
IUPAC Name(3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone
SMILESO=C(c1ccc(N2CCOCC2)nc1)N1CCCC(n2ccnc2)C1
InChIInChI=1S/C18H23N5O2/c24-18(22-6-1-2-16(13-22)23-7-5-19-14-23)15-3-4-17(20-12-15)21-8-10-25-11-9-21/h3-5,7,12,14,16H,1-2,6,8-11,13H2
InChIKeyYCOPSBYJHXOKGD-UHFFFAOYSA-N
XLogP1.59
TPSA63.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone?
The IUPAC name of (3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone (CID 56801172) is (3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone.
What is the SMILES notation for (3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone?
The canonical SMILES for (3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone is O=C(c1ccc(N2CCOCC2)nc1)N1CCCC(n2ccnc2)C1.
What is the InChIKey of (3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone?
The InChIKey is YCOPSBYJHXOKGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O2/c24-18(22-6-1-2-16(13-22)23-7-5-19-14-23)15-3-4-17(20-12-15)21-8-10-25-11-9-21/h3-5,7,12,14,16H,1-2,6,8-11,13H2.
What are the key properties of (3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone?
(3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone has a molecular weight of 341.42 g/mol, XLogP of 1.59, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3-imidazol-1-ylpiperidin-1-yl)-(6-morpholin-4-yl-3-pyridinyl)methanone is sourced from PubChem (CID 56801172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).