4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide

C15H23N3O3 — CID 60850523

IUPAC4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide
SMILESCOCCn1cc(NC(=O)C2CCC(N)CC2)ccc1=O
InChIInChI=1S/C15H23N3O3/c1-21-9-8-18-10-13(6-7-14(18)19)17-15(20)11-2-4-12(16)5-3-11/h6-7,10-12H,2-5,8-9,16H2,1H3,(H,17,20)
InChIKeyKMXVLWFTMVZPNX-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.95
Rot. Bonds5

About 4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide

4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide (PubChem CID 60850523) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide
PubChem CID60850523
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide
SMILESCOCCn1cc(NC(=O)C2CCC(N)CC2)ccc1=O
InChIInChI=1S/C15H23N3O3/c1-21-9-8-18-10-13(6-7-14(18)19)17-15(20)11-2-4-12(16)5-3-11/h6-7,10-12H,2-5,8-9,16H2,1H3,(H,17,20)
InChIKeyKMXVLWFTMVZPNX-UHFFFAOYSA-N
XLogP0.95
TPSA86.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide?
The IUPAC name of 4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide (CID 60850523) is 4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide is COCCn1cc(NC(=O)C2CCC(N)CC2)ccc1=O.
What is the InChIKey of 4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide?
The InChIKey is KMXVLWFTMVZPNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-21-9-8-18-10-13(6-7-14(18)19)17-15(20)11-2-4-12(16)5-3-11/h6-7,10-12H,2-5,8-9,16H2,1H3,(H,17,20).
What are the key properties of 4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide?
4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 0.95, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 60850523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).