N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide

C17H25N3O2 — CID 119827619

IUPACN-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide
SMILESO=C(NC1CCN(Cc2ccccc2)CC1)C1CNCCO1
InChIInChI=1S/C17H25N3O2/c21-17(16-12-18-8-11-22-16)19-15-6-9-20(10-7-15)13-14-4-2-1-3-5-14/h1-5,15-16,18H,6-13H2,(H,19,21)
InChIKeyYDAIJWJHGRBRHS-UHFFFAOYSA-N
MW303.41 g/mol
LogP0.76
Rot. Bonds4

About N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide

N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide (PubChem CID 119827619) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide
PubChem CID119827619
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC NameN-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide
SMILESO=C(NC1CCN(Cc2ccccc2)CC1)C1CNCCO1
InChIInChI=1S/C17H25N3O2/c21-17(16-12-18-8-11-22-16)19-15-6-9-20(10-7-15)13-14-4-2-1-3-5-14/h1-5,15-16,18H,6-13H2,(H,19,21)
InChIKeyYDAIJWJHGRBRHS-UHFFFAOYSA-N
XLogP0.76
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide (CID 119827619) is N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide is O=C(NC1CCN(Cc2ccccc2)CC1)C1CNCCO1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide?
The InChIKey is YDAIJWJHGRBRHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c21-17(16-12-18-8-11-22-16)19-15-6-9-20(10-7-15)13-14-4-2-1-3-5-14/h1-5,15-16,18H,6-13H2,(H,19,21).
What are the key properties of N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide?
N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide has a molecular weight of 303.41 g/mol, XLogP of 0.76, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide is sourced from PubChem (CID 119827619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).