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

C19H28N4O2 — CID 56751831

IUPAC(4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone
SMILESO=C(c1ccc(N2CCCC2)nc1)N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C19H28N4O2/c24-19(16-3-4-18(20-15-16)22-7-1-2-8-22)23-9-5-17(6-10-23)21-11-13-25-14-12-21/h3-4,15,17H,1-2,5-14H2
InChIKeyLMFKDMKXHMNLPK-UHFFFAOYSA-N
MW344.46 g/mol
LogP1.62
Rot. Bonds3

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

(4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone (PubChem CID 56751831) has the molecular formula C19H28N4O2 and a molecular weight of 344.46 g/mol. Its IUPAC name is (4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone.

Molecular Properties

Compound Name(4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone
PubChem CID56751831
Molecular FormulaC19H28N4O2
Molecular Weight344.46 g/mol
Exact Mass344.22
IUPAC Name(4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone
SMILESO=C(c1ccc(N2CCCC2)nc1)N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C19H28N4O2/c24-19(16-3-4-18(20-15-16)22-7-1-2-8-22)23-9-5-17(6-10-23)21-11-13-25-14-12-21/h3-4,15,17H,1-2,5-14H2
InChIKeyLMFKDMKXHMNLPK-UHFFFAOYSA-N
XLogP1.62
TPSA48.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone?
The IUPAC name of (4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone (CID 56751831) is (4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone.
What is the SMILES notation for (4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone?
The canonical SMILES for (4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone is O=C(c1ccc(N2CCCC2)nc1)N1CCC(N2CCOCC2)CC1.
What is the InChIKey of (4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone?
The InChIKey is LMFKDMKXHMNLPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O2/c24-19(16-3-4-18(20-15-16)22-7-1-2-8-22)23-9-5-17(6-10-23)21-11-13-25-14-12-21/h3-4,15,17H,1-2,5-14H2.
What are the key properties of (4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone?
(4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone has a molecular weight of 344.46 g/mol, XLogP of 1.62, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-morpholin-4-ylpiperidin-1-yl)-(6-pyrrolidin-1-yl-3-pyridinyl)methanone is sourced from PubChem (CID 56751831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).