N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine

C15H21N5O — CID 164642738

IUPACN-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine
SMILESCCN(C[C@H]1CCCCO1)c1nnnn1-c1ccccc1
InChIInChI=1S/C15H21N5O/c1-2-19(12-14-10-6-7-11-21-14)15-16-17-18-20(15)13-8-4-3-5-9-13/h3-5,8-9,14H,2,6-7,10-12H2,1H3/t14-/m1/s1
InChIKeyUDPYROGIWUJCSL-CQSZACIVSA-N
MW287.37 g/mol
LogP2.06
Rot. Bonds5

About N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine

N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine (PubChem CID 164642738) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine.

Molecular Properties

Compound NameN-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine
PubChem CID164642738
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC NameN-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine
SMILESCCN(C[C@H]1CCCCO1)c1nnnn1-c1ccccc1
InChIInChI=1S/C15H21N5O/c1-2-19(12-14-10-6-7-11-21-14)15-16-17-18-20(15)13-8-4-3-5-9-13/h3-5,8-9,14H,2,6-7,10-12H2,1H3/t14-/m1/s1
InChIKeyUDPYROGIWUJCSL-CQSZACIVSA-N
XLogP2.06
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-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

4-[(1-phenyl-1H-tetraazol-5-yl)methyl]morpholine
CID 3029444
5-isopropoxy-1-phenyl-1H-tetrazole
CID 1263322
4-(1-phenyl-1H-tetrazol-5-yl)morpholine
CID 1281750
4-(5-Morpholin-4-ylmethyl-tetrazol-1-yl)-phenylamine
CID 3184571
ethyl 4-(1-phenyl-1H-tetraazol-5-yl)-1-piperazinecarboxylate
CID 1253040
N-(3-morpholin-4-ylpropyl)-1-phenyltetrazol-5-amine
CID 2453962
2,6-Dimethyl-4-(1-phenyltetrazol-5-yl)morpholine
CID 2928885
1-(2-Methoxyethyl)-4-[3-(1-phenyltetrazol-5-yl)propyl]piperazine
CID 53534390
1-(2-Ethoxyethyl)-4-[3-(1-phenyltetrazol-5-yl)propyl]piperazine
CID 53590620
4-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}morpholine
CID 4439931
1-(1-phenyl-1H-tetrazol-5-yl)piperidine
CID 5306184
4-(2-Fluoro-4-(1h-tetrazol-1-yl)phenyl)morpholine
CID 162787637

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine?
The IUPAC name of N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine (CID 164642738) is N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine.
What is the SMILES notation for N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine?
The canonical SMILES for N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine is CCN(C[C@H]1CCCCO1)c1nnnn1-c1ccccc1.
What is the InChIKey of N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine?
The InChIKey is UDPYROGIWUJCSL-CQSZACIVSA-N. The full InChI is InChI=1S/C15H21N5O/c1-2-19(12-14-10-6-7-11-21-14)15-16-17-18-20(15)13-8-4-3-5-9-13/h3-5,8-9,14H,2,6-7,10-12H2,1H3/t14-/m1/s1.
What are the key properties of N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine?
N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine has a molecular weight of 287.37 g/mol, XLogP of 2.06, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[[(2R)-oxan-2-yl]methyl]-1-phenyltetrazol-5-amine is sourced from PubChem (CID 164642738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).