N-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide

C18H28N2O2 — CID 54825123

IUPACN-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide
SMILESCCCOc1cccc(NCC(=O)N(C)C2CCCCC2)c1
InChIInChI=1S/C18H28N2O2/c1-3-12-22-17-11-7-8-15(13-17)19-14-18(21)20(2)16-9-5-4-6-10-16/h7-8,11,13,16,19H,3-6,9-10,12,14H2,1-2H3
InChIKeyUWIMIEDAGIQKHY-UHFFFAOYSA-N
MW304.43 g/mol
LogP3.68
Rot. Bonds7

About N-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide

N-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide (PubChem CID 54825123) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide
PubChem CID54825123
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC NameN-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide
SMILESCCCOc1cccc(NCC(=O)N(C)C2CCCCC2)c1
InChIInChI=1S/C18H28N2O2/c1-3-12-22-17-11-7-8-15(13-17)19-14-18(21)20(2)16-9-5-4-6-10-16/h7-8,11,13,16,19H,3-6,9-10,12,14H2,1-2H3
InChIKeyUWIMIEDAGIQKHY-UHFFFAOYSA-N
XLogP3.68
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-cyclohexyl-N'-methyl-N-(3-propoxyphenyl)ethane-1,2-diamine
CID 54809683
N-cyclohexyl-2-(4-hexoxyanilino)-N-methylacetamide
CID 54821088
3-[[2-[cyclohexyl(methyl)amino]-2-oxoethyl]amino]-N-propylbenzamide
CID 54838807
1-(azepan-1-yl)-2-(3-propoxyanilino)ethanone
CID 54824937
N-[3-[[2-[cyclohexyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide
CID 54839417
N-(3-butoxyphenyl)-2-[cyclohexyl(methyl)amino]acetamide
CID 54818028
N-(oxolan-2-ylmethyl)-2-(3-propoxyanilino)acetamide
CID 54825001
N,N-diethyl-2-(3-heptoxyanilino)acetamide
CID 54829038
N-[3-[[2-(3-propoxyanilino)acetyl]amino]phenyl]propanamide
CID 54825188
N-cyclohexyl-2-(4-iodoanilino)-N-methylacetamide
CID 54812377
2-(dimethylamino)-N-(3-propoxyphenyl)acetamide
CID 54843924
N-cyclopropyl-N-methyl-2-(naphthalen-2-ylamino)acetamide
CID 61488971

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide?
The IUPAC name of N-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide (CID 54825123) is N-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide?
The canonical SMILES for N-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide is CCCOc1cccc(NCC(=O)N(C)C2CCCCC2)c1.
What is the InChIKey of N-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide?
The InChIKey is UWIMIEDAGIQKHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-3-12-22-17-11-7-8-15(13-17)19-14-18(21)20(2)16-9-5-4-6-10-16/h7-8,11,13,16,19H,3-6,9-10,12,14H2,1-2H3.
What are the key properties of N-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide?
N-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide has a molecular weight of 304.43 g/mol, XLogP of 3.68, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-2-(3-propoxyanilino)acetamide is sourced from PubChem (CID 54825123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).