1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine

C9H15N7 — CID 107065432

IUPAC1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine
SMILESCc1cc(C(N)Cc2nnn(C)n2)n(C)n1
InChIInChI=1S/C9H15N7/c1-6-4-8(15(2)12-6)7(10)5-9-11-14-16(3)13-9/h4,7H,5,10H2,1-3H3
InChIKeyNTVMLVDWXYRDGF-UHFFFAOYSA-N
MW221.27 g/mol
LogP-0.51
Rot. Bonds3

About 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine

1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine (PubChem CID 107065432) has the molecular formula C9H15N7 and a molecular weight of 221.27 g/mol. Its IUPAC name is 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine.

Molecular Properties

Compound Name1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine
PubChem CID107065432
Molecular FormulaC9H15N7
Molecular Weight221.27 g/mol
Exact Mass221.14
IUPAC Name1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine
SMILESCc1cc(C(N)Cc2nnn(C)n2)n(C)n1
InChIInChI=1S/C9H15N7/c1-6-4-8(15(2)12-6)7(10)5-9-11-14-16(3)13-9/h4,7H,5,10H2,1-3H3
InChIKeyNTVMLVDWXYRDGF-UHFFFAOYSA-N
XLogP-0.51
TPSA87.44 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.27
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanol
CID 107065836
1-(2,5-dimethylpyrazol-3-yl)-2-(2-methylphenyl)ethanamine
CID 105091850
2-(2-methyltetrazol-5-yl)-1-(3,4,5-trifluorophenyl)ethanamine
CID 107048810
3-amino-3-(2,5-dimethylpyrazol-3-yl)propan-1-ol
CID 82598008
1-(4-chlorophenyl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107048349
1-(4-methyl-3-pyridinyl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107051303
1-(2,5-dimethylpyrazol-3-yl)heptan-1-amine
CID 105126222
1-(2,5-dibromothiophen-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107969527
1-(3-bromophenyl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107048405
1-(3,5-dichloro-2-pyridinyl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107050223
1-(5-bromofuran-2-yl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107064809
1,1-diethoxy-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107050132

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine?
The IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine (CID 107065432) is 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine.
What is the SMILES notation for 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine?
The canonical SMILES for 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine is Cc1cc(C(N)Cc2nnn(C)n2)n(C)n1.
What is the InChIKey of 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine?
The InChIKey is NTVMLVDWXYRDGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N7/c1-6-4-8(15(2)12-6)7(10)5-9-11-14-16(3)13-9/h4,7H,5,10H2,1-3H3.
What are the key properties of 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine?
1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine has a molecular weight of 221.27 g/mol, XLogP of -0.51, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylpyrazol-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine is sourced from PubChem (CID 107065432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).