[6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone

C18H26N4O2 — CID 56742496

IUPAC[6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone
SMILESO=C(c1ccc(NC2CC2)nc1)N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C18H26N4O2/c23-18(14-1-4-17(19-13-14)20-15-2-3-15)22-7-5-16(6-8-22)21-9-11-24-12-10-21/h1,4,13,15-16H,2-3,5-12H2,(H,19,20)
InChIKeyMZJYYJIJFJKNSC-UHFFFAOYSA-N
MW330.43 g/mol
LogP1.59
Rot. Bonds4

About [6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone

[6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone (PubChem CID 56742496) has the molecular formula C18H26N4O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is [6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone
PubChem CID56742496
Molecular FormulaC18H26N4O2
Molecular Weight330.43 g/mol
Exact Mass330.21
IUPAC Name[6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone
SMILESO=C(c1ccc(NC2CC2)nc1)N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C18H26N4O2/c23-18(14-1-4-17(19-13-14)20-15-2-3-15)22-7-5-16(6-8-22)21-9-11-24-12-10-21/h1,4,13,15-16H,2-3,5-12H2,(H,19,20)
InChIKeyMZJYYJIJFJKNSC-UHFFFAOYSA-N
XLogP1.59
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone?
The IUPAC name of [6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone (CID 56742496) is [6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone.
What is the SMILES notation for [6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone?
The canonical SMILES for [6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone is O=C(c1ccc(NC2CC2)nc1)N1CCC(N2CCOCC2)CC1.
What is the InChIKey of [6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone?
The InChIKey is MZJYYJIJFJKNSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O2/c23-18(14-1-4-17(19-13-14)20-15-2-3-15)22-7-5-16(6-8-22)21-9-11-24-12-10-21/h1,4,13,15-16H,2-3,5-12H2,(H,19,20).
What are the key properties of [6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone?
[6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone has a molecular weight of 330.43 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone is sourced from PubChem (CID 56742496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).