N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine

C11H15N5 — CID 53009736

IUPACN-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine
SMILESCNC(C)(C)c1nnnn1-c1ccccc1
InChIInChI=1S/C11H15N5/c1-11(2,12-3)10-13-14-15-16(10)9-7-5-4-6-8-9/h4-8,12H,1-3H3
InChIKeyIDEMZGFWYWKKNB-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.12
Rot. Bonds3

About N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine

N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine (PubChem CID 53009736) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine.

Molecular Properties

Compound NameN-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine
PubChem CID53009736
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC NameN-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine
SMILESCNC(C)(C)c1nnnn1-c1ccccc1
InChIInChI=1S/C11H15N5/c1-11(2,12-3)10-13-14-15-16(10)9-7-5-4-6-8-9/h4-8,12H,1-3H3
InChIKeyIDEMZGFWYWKKNB-UHFFFAOYSA-N
XLogP1.12
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-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-methyl-2-[1-(3-methylphenyl)tetrazol-5-yl]propan-2-amine
CID 53009741
N-methyl-2-[1-(2-methylphenyl)tetrazol-5-yl]propan-2-amine
CID 53009733
1-phenyl-5-(trichloromethyl)tetrazole
CID 69031476
1-phenyl-5-(trifluoromethyl)tetrazole
CID 11206655
5-(1,1,2,2,2-pentafluoroethyl)-1-phenyltetrazole
CID 87664913
1-phenyltetrazole-5-selenol
CID 173399228
2,3-dimethyl-3-[(1-phenyltetrazol-5-yl)amino]butan-2-ol
CID 106186033
1-phenyl-5-[(1-phenyltetrazol-5-yl)methyl]tetrazole
CID 3090521
4-[(2R)-2-(1-phenyltetrazol-5-yl)butan-2-yl]morpholine
CID 51698124
(1-phenyltetrazol-5-yl)sulfanylcarbamic acid
CID 19435783
S-(1-phenyltetrazol-5-yl)thiohydroxylamine
CID 170760951
2-methyl-2-[(1-phenyltetrazol-5-yl)methylamino]propane-1,3-diol
CID 79811196

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine?
The IUPAC name of N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine (CID 53009736) is N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine.
What is the SMILES notation for N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine?
The canonical SMILES for N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine is CNC(C)(C)c1nnnn1-c1ccccc1.
What is the InChIKey of N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine?
The InChIKey is IDEMZGFWYWKKNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-11(2,12-3)10-13-14-15-16(10)9-7-5-4-6-8-9/h4-8,12H,1-3H3.
What are the key properties of N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine?
N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine has a molecular weight of 217.28 g/mol, XLogP of 1.12, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1-phenyltetrazol-5-yl)propan-2-amine is sourced from PubChem (CID 53009736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).