[1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine

C9H17N5 — CID 10176518

IUPAC[1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine
SMILESNCC1(Cc2nn[nH]n2)CCCCC1
InChIInChI=1S/C9H17N5/c10-7-9(4-2-1-3-5-9)6-8-11-13-14-12-8/h1-7,10H2,(H,11,12,13,14)
InChIKeyOHNKRFQIDUFFNJ-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.65
Rot. Bonds3

About [1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine

[1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine (PubChem CID 10176518) has the molecular formula C9H17N5 and a molecular weight of 195.27 g/mol. Its IUPAC name is [1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine
PubChem CID10176518
Molecular FormulaC9H17N5
Molecular Weight195.27 g/mol
Exact Mass195.15
IUPAC Name[1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine
SMILESNCC1(Cc2nn[nH]n2)CCCCC1
InChIInChI=1S/C9H17N5/c10-7-9(4-2-1-3-5-9)6-8-11-13-14-12-8/h1-7,10H2,(H,11,12,13,14)
InChIKeyOHNKRFQIDUFFNJ-UHFFFAOYSA-N
XLogP0.65
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-methyl-4-(2H-tetrazol-5-ylmethyl)piperidin-4-yl]methanamine
CID 18614309
5-[[1-(2H-tetrazol-5-yl)cycloheptyl]methyl]-2H-tetrazole
CID 117065742
5-[[1-(aminomethyl)cyclohexyl]methyl]-1,2,4-oxadiazol-3-amine
CID 65417050
1-(2H-tetrazol-5-yl)cyclooctan-1-amine
CID 61150852
1-(2H-tetrazol-5-yl)cyclohexan-1-amine
CID 61149474
[1-(aminomethyl)cyclohexyl]methanamine;platinum(2+);dichloride
CID 10250859
2-(1-aminocyclohexyl)-N-(2H-tetrazol-5-ylmethyl)acetamide
CID 64677423
(1-benzylcycloheptyl)methanamine
CID 65391702
(1-benzylcyclooctyl)methanamine
CID 80602159
[1-[(1-methyltriazol-4-yl)methyl]cyclooctyl]methanamine
CID 107057461
[1-(1H-1,2,4-triazol-5-ylmethyl)cyclobutyl]methanamine
CID 81167530
[1-(aminomethyl)cyclopentyl]methanethiol
CID 83678920

Frequently Asked Questions

What is the IUPAC name of [1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine?
The IUPAC name of [1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine (CID 10176518) is [1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine.
What is the SMILES notation for [1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine?
The canonical SMILES for [1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine is NCC1(Cc2nn[nH]n2)CCCCC1.
What is the InChIKey of [1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine?
The InChIKey is OHNKRFQIDUFFNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5/c10-7-9(4-2-1-3-5-9)6-8-11-13-14-12-8/h1-7,10H2,(H,11,12,13,14).
What are the key properties of [1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine?
[1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine has a molecular weight of 195.27 g/mol, XLogP of 0.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2H-tetrazol-5-ylmethyl)cyclohexyl]methanamine is sourced from PubChem (CID 10176518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).