N-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide

C15H22ClN3O — CID 47118067

IUPACN-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide
SMILESCC1CCC(N(C)CC(=O)Nc2ccc(Cl)cn2)CC1
InChIInChI=1S/C15H22ClN3O/c1-11-3-6-13(7-4-11)19(2)10-15(20)18-14-8-5-12(16)9-17-14/h5,8-9,11,13H,3-4,6-7,10H2,1-2H3,(H,17,18,20)
InChIKeyMNGIGNDDANVRHG-UHFFFAOYSA-N
MW295.81 g/mol
LogP3.18
Rot. Bonds4

About N-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide

N-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide (PubChem CID 47118067) has the molecular formula C15H22ClN3O and a molecular weight of 295.81 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide
PubChem CID47118067
Molecular FormulaC15H22ClN3O
Molecular Weight295.81 g/mol
Exact Mass295.15
IUPAC NameN-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide
SMILESCC1CCC(N(C)CC(=O)Nc2ccc(Cl)cn2)CC1
InChIInChI=1S/C15H22ClN3O/c1-11-3-6-13(7-4-11)19(2)10-15(20)18-14-8-5-12(16)9-17-14/h5,8-9,11,13H,3-4,6-7,10H2,1-2H3,(H,17,18,20)
InChIKeyMNGIGNDDANVRHG-UHFFFAOYSA-N
XLogP3.18
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.81
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 110881682
N-(5-chloro-2-pyridinyl)-4-methylpiperidine-2-carboxamide
CID 114422738
N-(5-chloro-2-pyridinyl)-2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-methylamino]acetamide
CID 46601522
2-[(2-amino-2-oxoethyl)sulfonyl-(1-propan-2-ylpiperidin-4-yl)amino]-N-(5-chloro-2-pyridinyl)acetamide
CID 68824377
2-[cyclopropyl(ethyl)amino]-N-(5-iodo-2-pyridinyl)acetamide
CID 75438366
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-chloro-2-pyridinyl)acetamide
CID 79607334
5-chloro-N-methyl-N-(4-methylcyclohexyl)pyridin-2-amine
CID 66232762
2-[methyl-(4-methylcyclohexyl)amino]-N-(4-nitrophenyl)acetamide
CID 55381834
2-[methyl-(4-methylcyclohexyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 51226770
N-(2-aminoethyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide
CID 61438988
2-[(5-chloro-2-pyridinyl)amino]-2-oxoacetyl chloride
CID 152602540
N-(5-chloro-2-pyridinyl)-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 27161179

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide (CID 47118067) is N-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide is CC1CCC(N(C)CC(=O)Nc2ccc(Cl)cn2)CC1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide?
The InChIKey is MNGIGNDDANVRHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClN3O/c1-11-3-6-13(7-4-11)19(2)10-15(20)18-14-8-5-12(16)9-17-14/h5,8-9,11,13H,3-4,6-7,10H2,1-2H3,(H,17,18,20).
What are the key properties of N-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide?
N-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide has a molecular weight of 295.81 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide is sourced from PubChem (CID 47118067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).