4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide

C14H21N3O2 — CID 54862564

IUPAC4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide
SMILESCCn1cc(NC(=O)C2CCC(N)CC2)ccc1=O
InChIInChI=1S/C14H21N3O2/c1-2-17-9-12(7-8-13(17)18)16-14(19)10-3-5-11(15)6-4-10/h7-11H,2-6,15H2,1H3,(H,16,19)
InChIKeyONCVDTMRSFKRLH-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.32
Rot. Bonds3

About 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide

4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide (PubChem CID 54862564) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide
PubChem CID54862564
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide
SMILESCCn1cc(NC(=O)C2CCC(N)CC2)ccc1=O
InChIInChI=1S/C14H21N3O2/c1-2-17-9-12(7-8-13(17)18)16-14(19)10-3-5-11(15)6-4-10/h7-11H,2-6,15H2,1H3,(H,16,19)
InChIKeyONCVDTMRSFKRLH-UHFFFAOYSA-N
XLogP1.32
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide?
The IUPAC name of 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide (CID 54862564) is 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide is CCn1cc(NC(=O)C2CCC(N)CC2)ccc1=O.
What is the InChIKey of 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide?
The InChIKey is ONCVDTMRSFKRLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-2-17-9-12(7-8-13(17)18)16-14(19)10-3-5-11(15)6-4-10/h7-11H,2-6,15H2,1H3,(H,16,19).
What are the key properties of 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide?
4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 54862564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).