5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide

C16H25N3O — CID 104640456

IUPAC5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NCC2CCCCC2C)nc1
InChIInChI=1S/C16H25N3O/c1-3-17-14-8-9-15(18-11-14)16(20)19-10-13-7-5-4-6-12(13)2/h8-9,11-13,17H,3-7,10H2,1-2H3,(H,19,20)
InChIKeyDIZOFMFJWCCTIL-UHFFFAOYSA-N
MW275.40 g/mol
LogP3.07
Rot. Bonds5

About 5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide

5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide (PubChem CID 104640456) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide
PubChem CID104640456
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NCC2CCCCC2C)nc1
InChIInChI=1S/C16H25N3O/c1-3-17-14-8-9-15(18-11-14)16(20)19-10-13-7-5-4-6-12(13)2/h8-9,11-13,17H,3-7,10H2,1-2H3,(H,19,20)
InChIKeyDIZOFMFJWCCTIL-UHFFFAOYSA-N
XLogP3.07
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-[(2-methylcyclopentyl)methyl]pyridine-2-carboxamide
CID 107418817
5-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]pyridine-2-carboxamide
CID 104640017
5-[(2-methylcyclohexyl)methylamino]pyridine-2-carbothioamide
CID 115488450
4-chloro-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide
CID 54983100
5-hydrazinyl-N-[(2-methylcyclohexyl)methyl]pyrazine-2-carboxamide
CID 107377630
N-(2,3-dimethylcyclopentyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104641575
6-hydrazinyl-N-[(2-methylcyclohexyl)methyl]pyridazine-3-carboxamide
CID 55052556
N-[(2-methylcyclohexyl)methyl]-4-(propylamino)benzamide
CID 62181510
N-[[2-(chloromethyl)cyclohexyl]methyl]-5-fluoropyridine-2-carboxamide
CID 104643161
5-(ethylamino)-N-(4-methylcyclohexyl)pyridine-2-carboxamide
CID 104639829
N-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104641687
5-chloro-2-(ethylamino)-N-[(2-methylcyclohexyl)methyl]benzamide
CID 63500607

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide?
The IUPAC name of 5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide (CID 104640456) is 5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide is CCNc1ccc(C(=O)NCC2CCCCC2C)nc1.
What is the InChIKey of 5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide?
The InChIKey is DIZOFMFJWCCTIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-3-17-14-8-9-15(18-11-14)16(20)19-10-13-7-5-4-6-12(13)2/h8-9,11-13,17H,3-7,10H2,1-2H3,(H,19,20).
What are the key properties of 5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide?
5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 3.07, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 104640456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).