4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide

C18H26N4O3 — CID 56886758

IUPAC4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide
SMILESO=C(CC1COCCN1)NC1CCN(C(=O)Nc2ccccc2)CC1
InChIInChI=1S/C18H26N4O3/c23-17(12-16-13-25-11-8-19-16)20-15-6-9-22(10-7-15)18(24)21-14-4-2-1-3-5-14/h1-5,15-16,19H,6-13H2,(H,20,23)(H,21,24)
InChIKeyMHWFJAFXOGJDPF-UHFFFAOYSA-N
MW346.43 g/mol
LogP1.18
Rot. Bonds4

About 4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide

4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide (PubChem CID 56886758) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is 4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide
PubChem CID56886758
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC Name4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide
SMILESO=C(CC1COCCN1)NC1CCN(C(=O)Nc2ccccc2)CC1
InChIInChI=1S/C18H26N4O3/c23-17(12-16-13-25-11-8-19-16)20-15-6-9-22(10-7-15)18(24)21-14-4-2-1-3-5-14/h1-5,15-16,19H,6-13H2,(H,20,23)(H,21,24)
InChIKeyMHWFJAFXOGJDPF-UHFFFAOYSA-N
XLogP1.18
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 51.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide?
The IUPAC name of 4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide (CID 56886758) is 4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide?
The canonical SMILES for 4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide is O=C(CC1COCCN1)NC1CCN(C(=O)Nc2ccccc2)CC1.
What is the InChIKey of 4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide?
The InChIKey is MHWFJAFXOGJDPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c23-17(12-16-13-25-11-8-19-16)20-15-6-9-22(10-7-15)18(24)21-14-4-2-1-3-5-14/h1-5,15-16,19H,6-13H2,(H,20,23)(H,21,24).
What are the key properties of 4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide?
4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide has a molecular weight of 346.43 g/mol, XLogP of 1.18, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-morpholin-3-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 56886758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).