N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide

C18H26N6O — CID 46957593

IUPACN-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide
SMILESCc1nnnn1-c1ccc(CC(=O)NCCN2CCC(C)CC2)cc1
InChIInChI=1S/C18H26N6O/c1-14-7-10-23(11-8-14)12-9-19-18(25)13-16-3-5-17(6-4-16)24-15(2)20-21-22-24/h3-6,14H,7-13H2,1-2H3,(H,19,25)
InChIKeyNZLPZKLWDLLJQT-UHFFFAOYSA-N
MW342.45 g/mol
LogP1.36
Rot. Bonds6

About N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide

N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide (PubChem CID 46957593) has the molecular formula C18H26N6O and a molecular weight of 342.45 g/mol. Its IUPAC name is N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide
PubChem CID46957593
Molecular FormulaC18H26N6O
Molecular Weight342.45 g/mol
Exact Mass342.22
IUPAC NameN-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide
SMILESCc1nnnn1-c1ccc(CC(=O)NCCN2CCC(C)CC2)cc1
InChIInChI=1S/C18H26N6O/c1-14-7-10-23(11-8-14)12-9-19-18(25)13-16-3-5-17(6-4-16)24-15(2)20-21-22-24/h3-6,14H,7-13H2,1-2H3,(H,19,25)
InChIKeyNZLPZKLWDLLJQT-UHFFFAOYSA-N
XLogP1.36
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.45
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide
CID 131901816
N-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 55631991
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide
CID 74241272
N-[[(3S)-3,4-dihydro-2H-chromen-3-yl]methyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide
CID 97269669
2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride
CID 120642533
4-(3,4-dichlorophenyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]butanamide
CID 55883971
1-[(1S,5R)-3-(hydroxymethyl)-8-azabicyclo[3.2.1]octan-8-yl]-2-[4-(5-methyltetrazol-1-yl)phenyl]ethanone
CID 157020005
[(2S)-2-[2-(4-methylpiperidin-1-yl)ethyl]piperidin-1-yl]-[3-(5-methyltetrazol-1-yl)phenyl]methanone
CID 92614139
1-(1-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-[4-(5-methyltetrazol-1-yl)phenyl]ethanone
CID 46968468
N-[2-(4-methylpiperidin-1-yl)ethyl]furan-2-carboxamide
CID 60769782
2-(4-fluorophenyl)-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide
CID 94115488
N-[3-(4-methylpiperidin-1-yl)propyl]-4-(5-methylpyrazol-1-yl)benzamide
CID 35417488

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide?
The IUPAC name of N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide (CID 46957593) is N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide is Cc1nnnn1-c1ccc(CC(=O)NCCN2CCC(C)CC2)cc1.
What is the InChIKey of N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide?
The InChIKey is NZLPZKLWDLLJQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N6O/c1-14-7-10-23(11-8-14)12-9-19-18(25)13-16-3-5-17(6-4-16)24-15(2)20-21-22-24/h3-6,14H,7-13H2,1-2H3,(H,19,25).
What are the key properties of N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide?
N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide has a molecular weight of 342.45 g/mol, XLogP of 1.36, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[4-(5-methyltetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 46957593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).