(Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine

C9H9N5 — CID 6182061

IUPAC(Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine
SMILESCn1nnnc1/N=C\c1ccccc1
InChIInChI=1S/C9H9N5/c1-14-9(11-12-13-14)10-7-8-5-3-2-4-6-8/h2-7H,1H3/b10-7-
InChIKeyLFOQTBBBZOWIRK-YFHOEESVSA-N
MW187.21 g/mol
LogP0.96
Rot. Bonds2

About (Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine

(Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine (PubChem CID 6182061) has the molecular formula C9H9N5 and a molecular weight of 187.21 g/mol. Its IUPAC name is (Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine.

Molecular Properties

Compound Name(Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine
PubChem CID6182061
Molecular FormulaC9H9N5
Molecular Weight187.21 g/mol
Exact Mass187.09
IUPAC Name(Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine
SMILESCn1nnnc1/N=C\c1ccccc1
InChIInChI=1S/C9H9N5/c1-14-9(11-12-13-14)10-7-8-5-3-2-4-6-8/h2-7H,1H3/b10-7-
InChIKeyLFOQTBBBZOWIRK-YFHOEESVSA-N
XLogP0.96
TPSA55.96 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.21
LogP ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(E)-N-[4-[(E)-benzylideneamino]-5-methyl-1,2,4-triazol-3-yl]-1-phenylmethanimine
CID 172916281
N-(4,6-dimethylpyrimidin-2-yl)-1-phenylmethanimine
CID 3672393
N,1-diphenylmethanimine
CID 10858
N-[(Z)-benzylideneamino]-N-methyl-1-phenyltetrazol-5-amine
CID 6152131
ethane;N-methyl-1-phenylmethanimine
CID 90887000
1-methyl-5-(1-phenyltetrazol-5-yl)tetrazole
CID 57225080
CID 11342105
CID 11342105
1-methyl-5-[nitroso(phenyl)methyl]tetrazole
CID 91094725
(E)-N-[5-[[5-[(E)-benzylideneamino]-3-methyl-2-phenylimidazol-4-yl]disulfanyl]-1-methyl-2-phenylimidazol-4-yl]-1-phenylmethanimine
CID 46197979
5-(benzenesulfonyl)-1-methyltetrazole
CID 86201012
N-[4-[4-(benzylideneamino)-3,5-dimethylphenyl]-2,6-dimethylphenyl]-1-phenylmethanimine
CID 139193639
1-phenyl-N-[4-(4-phenylphenyl)phenyl]methanimine
CID 101426517

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine?
The IUPAC name of (Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine (CID 6182061) is (Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine.
What is the SMILES notation for (Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine?
The canonical SMILES for (Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine is Cn1nnnc1/N=C\c1ccccc1.
What is the InChIKey of (Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine?
The InChIKey is LFOQTBBBZOWIRK-YFHOEESVSA-N. The full InChI is InChI=1S/C9H9N5/c1-14-9(11-12-13-14)10-7-8-5-3-2-4-6-8/h2-7H,1H3/b10-7-.
What are the key properties of (Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine?
(Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine has a molecular weight of 187.21 g/mol, XLogP of 0.96, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(1-methyltetrazol-5-yl)-1-phenylmethanimine is sourced from PubChem (CID 6182061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).