1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine

C17H19N5O — CID 4727455

IUPAC1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine
SMILESCCn1nnnc1NCc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C17H19N5O/c1-2-22-17(19-20-21-22)18-12-14-8-10-16(11-9-14)23-13-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19,21)
InChIKeyRGPQTGJTACKDBR-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.88
Rot. Bonds7

About 1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine

1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine (PubChem CID 4727455) has the molecular formula C17H19N5O and a molecular weight of 309.37 g/mol. Its IUPAC name is 1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine.

Molecular Properties

Compound Name1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine
PubChem CID4727455
Molecular FormulaC17H19N5O
Molecular Weight309.37 g/mol
Exact Mass309.16
IUPAC Name1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine
SMILESCCn1nnnc1NCc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C17H19N5O/c1-2-22-17(19-20-21-22)18-12-14-8-10-16(11-9-14)23-13-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19,21)
InChIKeyRGPQTGJTACKDBR-UHFFFAOYSA-N
XLogP2.88
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2-bromo-5-methoxy-4-phenylmethoxyphenyl)methyl]-1-ethyltetrazol-5-amine
CID 66544536
N-[(4-propoxyphenyl)methyl]-1-propyltetrazol-5-amine
CID 44615786
N-[[3-[(4-chlorophenyl)methoxy]phenyl]methyl]-1-propyltetrazol-5-amine
CID 4727264
N-[[5-bromo-2-[(4-chlorophenyl)methoxy]phenyl]methyl]-1-ethyltetrazol-5-amine
CID 4727502
N-[(4-methoxyphenyl)methyl]-1-prop-2-enyltetrazol-5-amine
CID 4726685
2-ethyl-5-[(4-phenylmethoxyphenyl)methyl]tetrazole
CID 68649972
N-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methyl]-1-butyltetrazol-5-amine
CID 4725663
N-[[2-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]-1-ethyltetrazol-5-amine
CID 66545060
N-[(6-bromo-3-methoxy-2-phenylmethoxyphenyl)methyl]-1-propyltetrazol-5-amine
CID 66542960
1-methyl-N-[(4-phenylmethoxyphenyl)methyl]-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120969601
N-[[4-(2-methoxyethoxy)phenyl]methyl]-4-phenylmethoxyaniline
CID 54799476
N-[(4-phenylmethoxyphenyl)methyl]pyrrol-1-amine
CID 79091447

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine?
The IUPAC name of 1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine (CID 4727455) is 1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine.
What is the SMILES notation for 1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine?
The canonical SMILES for 1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine is CCn1nnnc1NCc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine?
The InChIKey is RGPQTGJTACKDBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O/c1-2-22-17(19-20-21-22)18-12-14-8-10-16(11-9-14)23-13-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19,21).
What are the key properties of 1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine?
1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine has a molecular weight of 309.37 g/mol, XLogP of 2.88, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[(4-phenylmethoxyphenyl)methyl]tetrazol-5-amine is sourced from PubChem (CID 4727455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).