N,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline

C10H13N5 — CID 59534456

IUPACN,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline
SMILESCNc1cc(C)cc(-c2nnnn2C)c1
InChIInChI=1S/C10H13N5/c1-7-4-8(6-9(5-7)11-2)10-12-13-14-15(10)3/h4-6,11H,1-3H3
InChIKeySACXDLRROOFSJO-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.23
Rot. Bonds2

About N,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline

N,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline (PubChem CID 59534456) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is N,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline.

Molecular Properties

Compound NameN,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline
PubChem CID59534456
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC NameN,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline
SMILESCNc1cc(C)cc(-c2nnnn2C)c1
InChIInChI=1S/C10H13N5/c1-7-4-8(6-9(5-7)11-2)10-12-13-14-15(10)3/h4-6,11H,1-3H3
InChIKeySACXDLRROOFSJO-UHFFFAOYSA-N
XLogP1.23
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline?
The IUPAC name of N,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline (CID 59534456) is N,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline.
What is the SMILES notation for N,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline?
The canonical SMILES for N,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline is CNc1cc(C)cc(-c2nnnn2C)c1.
What is the InChIKey of N,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline?
The InChIKey is SACXDLRROOFSJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1-7-4-8(6-9(5-7)11-2)10-12-13-14-15(10)3/h4-6,11H,1-3H3.
What are the key properties of N,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline?
N,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline has a molecular weight of 203.25 g/mol, XLogP of 1.23, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-5-(1-methyltetrazol-5-yl)aniline is sourced from PubChem (CID 59534456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).