N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide

C16H25N3O — CID 79872423

IUPACN-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ncccc1C(=O)NC1CCCCC1(C)C
InChIInChI=1S/C16H25N3O/c1-4-17-14-12(8-7-11-18-14)15(20)19-13-9-5-6-10-16(13,2)3/h7-8,11,13H,4-6,9-10H2,1-3H3,(H,17,18)(H,19,20)
InChIKeyJVVGULPQVMXNFD-UHFFFAOYSA-N
MW275.40 g/mol
LogP3.21
Rot. Bonds4

About N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide

N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide (PubChem CID 79872423) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide
PubChem CID79872423
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ncccc1C(=O)NC1CCCCC1(C)C
InChIInChI=1S/C16H25N3O/c1-4-17-14-12(8-7-11-18-14)15(20)19-13-9-5-6-10-16(13,2)3/h7-8,11,13H,4-6,9-10H2,1-3H3,(H,17,18)(H,19,20)
InChIKeyJVVGULPQVMXNFD-UHFFFAOYSA-N
XLogP3.21
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,1-dioxothian-4-yl)-2-(ethylamino)pyridine-3-carboxamide
CID 62169938
2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide
CID 113489132
2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide
CID 82737205
N-(dicyclopropylmethyl)-2-(ethylamino)pyridine-3-carboxamide
CID 62178341
N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(ethylamino)pyridine-3-carboxamide
CID 62167440
3-bromo-N-(2,2-dimethylcyclohexyl)-2-methylbenzamide
CID 79878594
N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide
CID 81443518
N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide
CID 62173888
3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-4-carboxamide
CID 79877759
2-[(2,2-dimethylcyclohexyl)amino]pyridine-3-carbothioamide
CID 79877924
2-(3-aminoprop-1-ynyl)-N-(2,2-dimethylcyclohexyl)benzamide
CID 79871842
N-methyl-2-[(1-methylcyclopentyl)methylamino]pyridine-3-carboxamide
CID 133321099

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide (CID 79872423) is N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide is CCNc1ncccc1C(=O)NC1CCCCC1(C)C.
What is the InChIKey of N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide?
The InChIKey is JVVGULPQVMXNFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-4-17-14-12(8-7-11-18-14)15(20)19-13-9-5-6-10-16(13,2)3/h7-8,11,13H,4-6,9-10H2,1-3H3,(H,17,18)(H,19,20).
What are the key properties of N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide?
N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 3.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 79872423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).