1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine

C15H21N5 — CID 3378751

IUPAC1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine
SMILESCCc1cccc(C)c1-n1nnnc1C1(N)CCCC1
InChIInChI=1S/C15H21N5/c1-3-12-8-6-7-11(2)13(12)20-14(17-18-19-20)15(16)9-4-5-10-15/h6-8H,3-5,9-10,16H2,1-2H3
InChIKeySMLSVDGBDDXSHJ-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.26
Rot. Bonds3

About 1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine

1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine (PubChem CID 3378751) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine
PubChem CID3378751
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine
SMILESCCc1cccc(C)c1-n1nnnc1C1(N)CCCC1
InChIInChI=1S/C15H21N5/c1-3-12-8-6-7-11(2)13(12)20-14(17-18-19-20)15(16)9-4-5-10-15/h6-8H,3-5,9-10,16H2,1-2H3
InChIKeySMLSVDGBDDXSHJ-UHFFFAOYSA-N
XLogP2.26
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]-N,N-dimethylcyclohexan-1-amine
CID 3508864
1-[1-(2,6-dimethylphenyl)tetrazol-5-yl]-N,N-dimethylcyclohexan-1-amine
CID 5024736
1-(1-phenyltetrazol-5-yl)cyclohexan-1-amine
CID 30309738
1-[1-[1-(2,6-dimethylphenyl)tetrazol-5-yl]cyclohexyl]piperidine
CID 43902752
N-[1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]ethyl]propan-1-amine
CID 103084748
N-[1-[1-(2,6-dimethylphenyl)tetrazol-5-yl]cyclopentyl]-2,2,2-trifluoroacetamide
CID 171981918
4-bromo-N-[1-[1-(2,6-dimethylphenyl)tetrazol-5-yl]cyclohexyl]aniline
CID 2829520
1-[1-(2,6-dimethylphenyl)tetrazol-5-yl]-N-ethyl-4-methylcyclohexan-1-amine
CID 30314444
1-[1-(2,6-dimethylphenyl)tetrazol-5-yl]-N-(2-methylbut-3-yn-2-yl)cyclohexan-1-amine
CID 3912904
ethyl N-[1-[1-(2,6-dimethylphenyl)tetrazol-5-yl]-4-methylcyclohexyl]-N-methylcarbamate
CID 30313837
3-(2-ethyl-6-methylphenyl)-5-phenyltriazol-4-amine
CID 82370553
1-(2-ethyl-6-methylphenyl)pyrrolidine
CID 168515642

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine?
The IUPAC name of 1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine (CID 3378751) is 1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine.
What is the SMILES notation for 1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine?
The canonical SMILES for 1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine is CCc1cccc(C)c1-n1nnnc1C1(N)CCCC1.
What is the InChIKey of 1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine?
The InChIKey is SMLSVDGBDDXSHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-3-12-8-6-7-11(2)13(12)20-14(17-18-19-20)15(16)9-4-5-10-15/h6-8H,3-5,9-10,16H2,1-2H3.
What are the key properties of 1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine?
1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine has a molecular weight of 271.37 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]cyclopentan-1-amine is sourced from PubChem (CID 3378751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).