N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide

C14H21N3O — CID 115268525

IUPACN-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide
SMILESCNc1ccc(N(C)C(=O)C2CCCCC2)cn1
InChIInChI=1S/C14H21N3O/c1-15-13-9-8-12(10-16-13)17(2)14(18)11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3,(H,15,16)
InChIKeyIHGWCQSPFKBPLN-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.67
Rot. Bonds3

About N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide

N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide (PubChem CID 115268525) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide
PubChem CID115268525
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide
SMILESCNc1ccc(N(C)C(=O)C2CCCCC2)cn1
InChIInChI=1S/C14H21N3O/c1-15-13-9-8-12(10-16-13)17(2)14(18)11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3,(H,15,16)
InChIKeyIHGWCQSPFKBPLN-UHFFFAOYSA-N
XLogP2.67
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(cyclopropylamino)-3-pyridinyl]-N-methylcyclopropanecarboxamide
CID 115268661
N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide
CID 142999335
N-[4-[acetyl(methyl)amino]phenyl]-N-methylcyclohexanecarboxamide
CID 113094811
N-(4-acetamidophenyl)-N-methylcyclohexanecarboxamide
CID 113094937
N-(4-carbamothioylphenyl)-N-methylcycloheptanecarboxamide
CID 62969973
N-(4-carbamothioylphenyl)-N-methylcyclohexanecarboxamide
CID 62971005
N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide
CID 113094578
2-[4-[cyclohexanecarbonyl(methyl)amino]phenyl]acetic acid
CID 28759748
N-(4-acetamidophenyl)-N-methylcyclobutanecarboxamide
CID 113095001
4-[(2-cyclohexylacetyl)amino]-N-(6-methoxy-3-pyridinyl)-N-methylcyclohexane-1-carboxamide
CID 60622821
N-[5-[4-(dimethylamino)anilino]-2-pyridinyl]cyclohexanecarboxamide
CID 113035496
N-(5-bromo-2-pyridinyl)-N-methylcyclohexanecarboxamide
CID 115268285

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide?
The IUPAC name of N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide (CID 115268525) is N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide.
What is the SMILES notation for N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide?
The canonical SMILES for N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide is CNc1ccc(N(C)C(=O)C2CCCCC2)cn1.
What is the InChIKey of N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide?
The InChIKey is IHGWCQSPFKBPLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-15-13-9-8-12(10-16-13)17(2)14(18)11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3,(H,15,16).
What are the key properties of N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide?
N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[6-(methylamino)-3-pyridinyl]cyclohexanecarboxamide is sourced from PubChem (CID 115268525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).