N-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide

C18H25N5O3 — CID 51048991

IUPACN-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide
SMILESCOc1ccc(OC)c(NC(=O)CC2(Cn3cnnn3)CCCCC2)c1
InChIInChI=1S/C18H25N5O3/c1-25-14-6-7-16(26-2)15(10-14)20-17(24)11-18(8-4-3-5-9-18)12-23-13-19-21-22-23/h6-7,10,13H,3-5,8-9,11-12H2,1-2H3,(H,20,24)
InChIKeyLKANDYJOUUKTMK-UHFFFAOYSA-N
MW359.43 g/mol
LogP2.67
Rot. Bonds7

About N-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide

N-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide (PubChem CID 51048991) has the molecular formula C18H25N5O3 and a molecular weight of 359.43 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide
PubChem CID51048991
Molecular FormulaC18H25N5O3
Molecular Weight359.43 g/mol
Exact Mass359.20
IUPAC NameN-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide
SMILESCOc1ccc(OC)c(NC(=O)CC2(Cn3cnnn3)CCCCC2)c1
InChIInChI=1S/C18H25N5O3/c1-25-14-6-7-16(26-2)15(10-14)20-17(24)11-18(8-4-3-5-9-18)12-23-13-19-21-22-23/h6-7,10,13H,3-5,8-9,11-12H2,1-2H3,(H,20,24)
InChIKeyLKANDYJOUUKTMK-UHFFFAOYSA-N
XLogP2.67
TPSA91.16 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2,5-dimethoxyphenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 2622579
N,N'-bis(2,5-dimethoxyphenyl)butanediamide
CID 1011774
2-[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl-N-(2,5-dimethoxyphenyl)acetamide
CID 35495479
N-(2,5-dimethoxyphenyl)-2-pyrrolidin-1-ylacetamide
CID 8901780
2-(diethylamino)-N-(2,5-dimethoxyphenyl)acetamide
CID 11666162
5-methoxy-2-[[2-(tetrazol-1-yl)acetyl]amino]benzoic acid
CID 78980899
N-(2,5-dimethoxyphenyl)-3-(1,2,4-triazol-1-yl)propanamide
CID 24663723
ethyl 3-(2,5-dimethoxyanilino)-3-oxopropanoate
CID 12866654
N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide
CID 17034633
N'-(2,5-dimethoxyphenyl)-N-(2-methoxy-5-methylphenyl)propanediamide
CID 108955778
N-(2,5-dimethoxyphenyl)-2-(4-methoxyphenoxy)acetamide
CID 676177
2-(4-aminopyrazol-1-yl)-N-(2,5-dimethoxyphenyl)acetamide
CID 43445334

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide (CID 51048991) is N-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide is COc1ccc(OC)c(NC(=O)CC2(Cn3cnnn3)CCCCC2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide?
The InChIKey is LKANDYJOUUKTMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O3/c1-25-14-6-7-16(26-2)15(10-14)20-17(24)11-18(8-4-3-5-9-18)12-23-13-19-21-22-23/h6-7,10,13H,3-5,8-9,11-12H2,1-2H3,(H,20,24).
What are the key properties of N-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide?
N-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide has a molecular weight of 359.43 g/mol, XLogP of 2.67, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide is sourced from PubChem (CID 51048991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).