N-cyclohexyl-2-(3,5-dimethylanilino)propanamide

C17H26N2O — CID 43083597

IUPACN-cyclohexyl-2-(3,5-dimethylanilino)propanamide
SMILESCc1cc(C)cc(NC(C)C(=O)NC2CCCCC2)c1
InChIInChI=1S/C17H26N2O/c1-12-9-13(2)11-16(10-12)18-14(3)17(20)19-15-7-5-4-6-8-15/h9-11,14-15,18H,4-8H2,1-3H3,(H,19,20)
InChIKeyWXVJHIIAPYMQKN-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.55
Rot. Bonds4

About N-cyclohexyl-2-(3,5-dimethylanilino)propanamide

N-cyclohexyl-2-(3,5-dimethylanilino)propanamide (PubChem CID 43083597) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-cyclohexyl-2-(3,5-dimethylanilino)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(3,5-dimethylanilino)propanamide
PubChem CID43083597
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-cyclohexyl-2-(3,5-dimethylanilino)propanamide
SMILESCc1cc(C)cc(NC(C)C(=O)NC2CCCCC2)c1
InChIInChI=1S/C17H26N2O/c1-12-9-13(2)11-16(10-12)18-14(3)17(20)19-15-7-5-4-6-8-15/h9-11,14-15,18H,4-8H2,1-3H3,(H,19,20)
InChIKeyWXVJHIIAPYMQKN-UHFFFAOYSA-N
XLogP3.55
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide
CID 79055402
(2S)-2-(4-bromo-3-methylanilino)-N-cyclohexylpropanamide
CID 7043625
(2R)-2-(4-bromoanilino)-N-cyclopentylpropanamide
CID 8005833
N-cyclopropyl-2-(4-methylanilino)propanamide
CID 43085895
N-cyclohexyl-2-(3-fluoroanilino)propanamide
CID 43083427
2-[(5-bromo-3-pyridinyl)amino]-N-cyclopentylpropanamide
CID 113350201
(2S)-2-(3-acetamidoanilino)-N-cyclohexylpropanamide
CID 40680935
(2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide
CID 28827851
3-[[1-(cyclohexylamino)-1-oxopropan-2-yl]amino]benzamide
CID 103600833
2-(3-acetamidoanilino)-N-cyclopentylpropanamide
CID 43083456
2-(3-chloro-4-fluoroanilino)-N-cyclohexylpropanamide
CID 78907261
N-cyclohexyl-2-(3-ethynylanilino)propanamide
CID 43114037

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(3,5-dimethylanilino)propanamide?
The IUPAC name of N-cyclohexyl-2-(3,5-dimethylanilino)propanamide (CID 43083597) is N-cyclohexyl-2-(3,5-dimethylanilino)propanamide.
What is the SMILES notation for N-cyclohexyl-2-(3,5-dimethylanilino)propanamide?
The canonical SMILES for N-cyclohexyl-2-(3,5-dimethylanilino)propanamide is Cc1cc(C)cc(NC(C)C(=O)NC2CCCCC2)c1.
What is the InChIKey of N-cyclohexyl-2-(3,5-dimethylanilino)propanamide?
The InChIKey is WXVJHIIAPYMQKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-12-9-13(2)11-16(10-12)18-14(3)17(20)19-15-7-5-4-6-8-15/h9-11,14-15,18H,4-8H2,1-3H3,(H,19,20).
What are the key properties of N-cyclohexyl-2-(3,5-dimethylanilino)propanamide?
N-cyclohexyl-2-(3,5-dimethylanilino)propanamide has a molecular weight of 274.41 g/mol, XLogP of 3.55, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(3,5-dimethylanilino)propanamide is sourced from PubChem (CID 43083597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).