N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide

C14H21N3O — CID 62171612

IUPACN-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccnc(C(=O)NC2CCCCC2)c1
InChIInChI=1S/C14H21N3O/c1-2-15-12-8-9-16-13(10-12)14(18)17-11-6-4-3-5-7-11/h8-11H,2-7H2,1H3,(H,15,16)(H,17,18)
InChIKeyHBGLUJABFSZYIF-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.58
Rot. Bonds4

About N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide

N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide (PubChem CID 62171612) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide
PubChem CID62171612
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccnc(C(=O)NC2CCCCC2)c1
InChIInChI=1S/C14H21N3O/c1-2-15-12-8-9-16-13(10-12)14(18)17-11-6-4-3-5-7-11/h8-11H,2-7H2,1H3,(H,15,16)(H,17,18)
InChIKeyHBGLUJABFSZYIF-UHFFFAOYSA-N
XLogP2.58
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide?
The IUPAC name of N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide (CID 62171612) is N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide is CCNc1ccnc(C(=O)NC2CCCCC2)c1.
What is the InChIKey of N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide?
The InChIKey is HBGLUJABFSZYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-2-15-12-8-9-16-13(10-12)14(18)17-11-6-4-3-5-7-11/h8-11H,2-7H2,1H3,(H,15,16)(H,17,18).
What are the key properties of N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide?
N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.58, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62171612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).