N-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine

C15H29N5 — CID 103086575

IUPACN-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine
SMILESCCNC(C)c1nnnn1CC1(CC(C)C)CCCC1
InChIInChI=1S/C15H29N5/c1-5-16-13(4)14-17-18-19-20(14)11-15(10-12(2)3)8-6-7-9-15/h12-13,16H,5-11H2,1-4H3
InChIKeyICWXNUIIIIAILH-UHFFFAOYSA-N
MW279.43 g/mol
LogP2.95
Rot. Bonds7

About N-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine

N-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine (PubChem CID 103086575) has the molecular formula C15H29N5 and a molecular weight of 279.43 g/mol. Its IUPAC name is N-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine
PubChem CID103086575
Molecular FormulaC15H29N5
Molecular Weight279.43 g/mol
Exact Mass279.24
IUPAC NameN-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine
SMILESCCNC(C)c1nnnn1CC1(CC(C)C)CCCC1
InChIInChI=1S/C15H29N5/c1-5-16-13(4)14-17-18-19-20(14)11-15(10-12(2)3)8-6-7-9-15/h12-13,16H,5-11H2,1-4H3
InChIKeyICWXNUIIIIAILH-UHFFFAOYSA-N
XLogP2.95
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-1-[1-[(1-ethylcyclopentyl)methyl]tetrazol-5-yl]ethanamine
CID 114125135
N-ethyl-1-[1-[(2-methyloxolan-2-yl)methyl]tetrazol-5-yl]ethanamine
CID 103086563
N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine
CID 103087026
N-[[1-[(1-ethylcyclopentyl)methyl]tetrazol-5-yl]methyl]propan-2-amine
CID 114125134
1-[1-(3,3-dimethylbutyl)tetrazol-5-yl]-N-ethylethanamine
CID 103087021
N-ethyl-1-[1-[2-(2-methylpropoxy)ethyl]tetrazol-5-yl]ethanamine
CID 103087047
N-ethyl-1-[1-(3-methylsulfanylpropyl)tetrazol-5-yl]ethanamine
CID 103086230
1-[1-(3-ethoxypropyl)tetrazol-5-yl]-N-ethylethanamine
CID 103085441
N-ethyl-1-[1-[2-(4-methylcyclohexyl)ethyl]tetrazol-5-yl]ethanamine
CID 103086274
N-methyl-1-[1-[(2-methylthiolan-2-yl)methyl]tetrazol-5-yl]ethanamine
CID 103086640
N-ethyl-1-[1-(2-phenylethyl)tetrazol-5-yl]ethanamine
CID 103085404
N-[1-[1-(2-cyclopentyloxyethyl)tetrazol-5-yl]ethyl]propan-1-amine
CID 103086194

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine?
The IUPAC name of N-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine (CID 103086575) is N-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine.
What is the SMILES notation for N-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine?
The canonical SMILES for N-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine is CCNC(C)c1nnnn1CC1(CC(C)C)CCCC1.
What is the InChIKey of N-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine?
The InChIKey is ICWXNUIIIIAILH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N5/c1-5-16-13(4)14-17-18-19-20(14)11-15(10-12(2)3)8-6-7-9-15/h12-13,16H,5-11H2,1-4H3.
What are the key properties of N-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine?
N-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine has a molecular weight of 279.43 g/mol, XLogP of 2.95, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[1-[[1-(2-methylpropyl)cyclopentyl]methyl]tetrazol-5-yl]ethanamine is sourced from PubChem (CID 103086575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).