4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine

C9H15N5 — CID 107058875

IUPAC4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine
SMILESCn1nnc(C=C2CCC(N)CC2)n1
InChIInChI=1S/C9H15N5/c1-14-12-9(11-13-14)6-7-2-4-8(10)5-3-7/h6,8H,2-5,10H2,1H3/b7-6-
InChIKeyUMKGGZXMUCNLSG-SREVYHEPSA-N
MW193.25 g/mol
LogP0.49
Rot. Bonds1

About 4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine

4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine (PubChem CID 107058875) has the molecular formula C9H15N5 and a molecular weight of 193.25 g/mol. Its IUPAC name is 4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine
PubChem CID107058875
Molecular FormulaC9H15N5
Molecular Weight193.25 g/mol
Exact Mass193.13
IUPAC Name4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine
SMILESCn1nnc(C=C2CCC(N)CC2)n1
InChIInChI=1S/C9H15N5/c1-14-12-9(11-13-14)6-7-2-4-8(10)5-3-7/h6,8H,2-5,10H2,1H3/b7-6-
InChIKeyUMKGGZXMUCNLSG-SREVYHEPSA-N
XLogP0.49
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-Cyclohexenyl)-5-methyltetrazole
CID 11423771
1-(Cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107050930
3-[(2-Methyltetrazol-5-yl)methyl]cyclohex-2-en-1-amine
CID 107054965
5,5-Dimethyl-3-[(2-methyltetrazol-5-yl)methyl]cyclohex-2-en-1-amine
CID 107054967
3-[(2-Methyltetrazol-5-yl)methyl]cyclopent-2-en-1-amine
CID 107054969
(3Z)-3-[(2-methyltetrazol-5-yl)methylidene]piperidine
CID 107058872
(3Z)-3-[(2-methyltetrazol-5-yl)methylidene]cyclopentan-1-amine
CID 107058886
(3Z)-3-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine
CID 107058892
2-[2-Methyl-3-(2-methyltetrazol-5-yl)prop-2-enyl]piperidine
CID 107058899
3-[(2-Methyltetrazol-5-yl)methylidene]cyclobutan-1-amine
CID 107058913
3-[(2-Methyltetrazol-5-yl)methyl]cyclohept-2-en-1-amine
CID 107383194
5-Methyl-3-(2-methyltetrazol-5-yl)cyclohex-2-en-1-amine
CID 130948613

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine?
The IUPAC name of 4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine (CID 107058875) is 4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine.
What is the SMILES notation for 4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine?
The canonical SMILES for 4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine is Cn1nnc(C=C2CCC(N)CC2)n1.
What is the InChIKey of 4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine?
The InChIKey is UMKGGZXMUCNLSG-SREVYHEPSA-N. The full InChI is InChI=1S/C9H15N5/c1-14-12-9(11-13-14)6-7-2-4-8(10)5-3-7/h6,8H,2-5,10H2,1H3/b7-6-.
What are the key properties of 4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine?
4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine has a molecular weight of 193.25 g/mol, XLogP of 0.49, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methyltetrazol-5-yl)methylidene]cyclohexan-1-amine is sourced from PubChem (CID 107058875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).