2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide

C19H30N4O2 — CID 119919788

IUPAC2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
SMILESCNC1CCCN(CC(=O)Nc2ccc(CN3CCOCC3)cc2)C1
InChIInChI=1S/C19H30N4O2/c1-20-18-3-2-8-23(14-18)15-19(24)21-17-6-4-16(5-7-17)13-22-9-11-25-12-10-22/h4-7,18,20H,2-3,8-15H2,1H3,(H,21,24)
InChIKeySCPOETOFEJTRNS-UHFFFAOYSA-N
MW346.48 g/mol
LogP1.14
Rot. Bonds6

About 2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide

2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide (PubChem CID 119919788) has the molecular formula C19H30N4O2 and a molecular weight of 346.48 g/mol. Its IUPAC name is 2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
PubChem CID119919788
Molecular FormulaC19H30N4O2
Molecular Weight346.48 g/mol
Exact Mass346.24
IUPAC Name2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
SMILESCNC1CCCN(CC(=O)Nc2ccc(CN3CCOCC3)cc2)C1
InChIInChI=1S/C19H30N4O2/c1-20-18-3-2-8-23(14-18)15-19(24)21-17-6-4-16(5-7-17)13-22-9-11-25-12-10-22/h4-7,18,20H,2-3,8-15H2,1H3,(H,21,24)
InChIKeySCPOETOFEJTRNS-UHFFFAOYSA-N
XLogP1.14
TPSA56.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.48
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide?
The IUPAC name of 2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide (CID 119919788) is 2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide.
What is the SMILES notation for 2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide?
The canonical SMILES for 2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide is CNC1CCCN(CC(=O)Nc2ccc(CN3CCOCC3)cc2)C1.
What is the InChIKey of 2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide?
The InChIKey is SCPOETOFEJTRNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O2/c1-20-18-3-2-8-23(14-18)15-19(24)21-17-6-4-16(5-7-17)13-22-9-11-25-12-10-22/h4-7,18,20H,2-3,8-15H2,1H3,(H,21,24).
What are the key properties of 2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide?
2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide has a molecular weight of 346.48 g/mol, XLogP of 1.14, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide is sourced from PubChem (CID 119919788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).