3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine

C11H21N5 — CID 107042459

IUPAC3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine
SMILESCCC1CCCC(NCc2nnn(C)n2)C1
InChIInChI=1S/C11H21N5/c1-3-9-5-4-6-10(7-9)12-8-11-13-15-16(2)14-11/h9-10,12H,3-8H2,1-2H3
InChIKeyADMFMQHCVQXAAY-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.27
Rot. Bonds4

About 3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine

3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine (PubChem CID 107042459) has the molecular formula C11H21N5 and a molecular weight of 223.32 g/mol. Its IUPAC name is 3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine
PubChem CID107042459
Molecular FormulaC11H21N5
Molecular Weight223.32 g/mol
Exact Mass223.18
IUPAC Name3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine
SMILESCCC1CCCC(NCc2nnn(C)n2)C1
InChIInChI=1S/C11H21N5/c1-3-9-5-4-6-10(7-9)12-8-11-13-15-16(2)14-11/h9-10,12H,3-8H2,1-2H3
InChIKeyADMFMQHCVQXAAY-UHFFFAOYSA-N
XLogP1.27
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[1-(3-ethylcyclohexyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066163
4-chloro-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine
CID 107054011
3-methyl-N-[(2-methyltetrazol-5-yl)methyl]cyclobutan-1-amine
CID 107042690
3-ethyl-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]cyclohexan-1-amine
CID 115685704
N-[(2,6-difluorophenyl)methyl]-3-ethylcyclohexan-1-amine
CID 64742190
N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-3-ethylcyclohexan-1-amine
CID 115651483
2-methyl-N-[(2-methyltetrazol-5-yl)methyl]cycloheptan-1-amine
CID 107042493
5-[(2-methyltetrazol-5-yl)methylamino]piperidin-2-one
CID 107042410
4-ethyl-2-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-one
CID 107044525
N-[(4-cyclopropylphenyl)methyl]-3-ethylcyclohexan-1-amine
CID 79983701
N-[(2-methyltetrazol-5-yl)methyl]bicyclo[2.2.1]heptan-2-amine
CID 107042445
cis-(1R,3S)-3-ethyl-N-methylcyclohexan-1-amine
CID 129149436

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine (CID 107042459) is 3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine is CCC1CCCC(NCc2nnn(C)n2)C1.
What is the InChIKey of 3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine?
The InChIKey is ADMFMQHCVQXAAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5/c1-3-9-5-4-6-10(7-9)12-8-11-13-15-16(2)14-11/h9-10,12H,3-8H2,1-2H3.
What are the key properties of 3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine?
3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine has a molecular weight of 223.32 g/mol, XLogP of 1.27, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[(2-methyltetrazol-5-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 107042459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).