3,4-di(propan-2-yl)-2H-tetrazol-5-amine

C7H17N5 — CID 142639925

IUPAC3,4-di(propan-2-yl)-2H-tetrazol-5-amine
SMILESCC(C)N1NN=C(N)N1C(C)C
InChIInChI=1S/C7H17N5/c1-5(2)11-7(8)9-10-12(11)6(3)4/h5-6,10H,1-4H3,(H2,8,9)
InChIKeyKZZAYGNFGHZQMT-UHFFFAOYSA-N
MW171.25 g/mol
LogP0.07
Rot. Bonds2

About 3,4-di(propan-2-yl)-2H-tetrazol-5-amine

3,4-di(propan-2-yl)-2H-tetrazol-5-amine (PubChem CID 142639925) has the molecular formula C7H17N5 and a molecular weight of 171.25 g/mol. Its IUPAC name is 3,4-di(propan-2-yl)-2H-tetrazol-5-amine.

Molecular Properties

Compound Name3,4-di(propan-2-yl)-2H-tetrazol-5-amine
PubChem CID142639925
Molecular FormulaC7H17N5
Molecular Weight171.25 g/mol
Exact Mass171.15
IUPAC Name3,4-di(propan-2-yl)-2H-tetrazol-5-amine
SMILESCC(C)N1NN=C(N)N1C(C)C
InChIInChI=1S/C7H17N5/c1-5(2)11-7(8)9-10-12(11)6(3)4/h5-6,10H,1-4H3,(H2,8,9)
InChIKeyKZZAYGNFGHZQMT-UHFFFAOYSA-N
XLogP0.07
TPSA56.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.25
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-Amino-1-propan-2-ylguanidine
CID 86084669
1-Propan-2-yl-1-(propan-2-ylamino)guanidine
CID 88441620
5-Imino-1,2-di(propan-2-yl)-1,2,4-triazol-3-amine
CID 118002806
1-Ethyl-5-imino-2-propan-2-yl-1,2,4-triazol-3-amine
CID 123563133
1-Amino-3-(diaminomethylidene)-1-propan-2-ylguanidine
CID 144894440
5-Methyl-2-propan-2-yl-1,5-dihydro-1,2,4-triazol-3-amine
CID 153551715
1-(2,3-dihydro-1H-tetrazol-5-yl)-1-propan-2-ylhydrazine
CID 155130431
1-(2,3-dihydro-1H-tetrazol-5-yl)-1-propylhydrazine
CID 155130432
5-amino-4-ethyl-2H-tetrazole-3-carbonitrile
CID 155675901
1,2,3-Triamino-1,3-di(propan-2-yl)guanidine
CID 156047684
1,2,3-Triamino-1-methyl-3-propan-2-ylguanidine
CID 156048215
1,2-Diamino-1-cyclopropylguanidine
CID 170075927

Frequently Asked Questions

What is the IUPAC name of 3,4-di(propan-2-yl)-2H-tetrazol-5-amine?
The IUPAC name of 3,4-di(propan-2-yl)-2H-tetrazol-5-amine (CID 142639925) is 3,4-di(propan-2-yl)-2H-tetrazol-5-amine.
What is the SMILES notation for 3,4-di(propan-2-yl)-2H-tetrazol-5-amine?
The canonical SMILES for 3,4-di(propan-2-yl)-2H-tetrazol-5-amine is CC(C)N1NN=C(N)N1C(C)C.
What is the InChIKey of 3,4-di(propan-2-yl)-2H-tetrazol-5-amine?
The InChIKey is KZZAYGNFGHZQMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N5/c1-5(2)11-7(8)9-10-12(11)6(3)4/h5-6,10H,1-4H3,(H2,8,9).
What are the key properties of 3,4-di(propan-2-yl)-2H-tetrazol-5-amine?
3,4-di(propan-2-yl)-2H-tetrazol-5-amine has a molecular weight of 171.25 g/mol, XLogP of 0.07, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-di(propan-2-yl)-2H-tetrazol-5-amine is sourced from PubChem (CID 142639925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).