N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine

C6H14N6 — CID 63152406

IUPACN',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine
SMILESCN(C)CCNc1nnnn1C
InChIInChI=1S/C6H14N6/c1-11(2)5-4-7-6-8-9-10-12(6)3/h4-5H2,1-3H3,(H,7,8,10)
InChIKeyUOQZLSDMLCPIFR-UHFFFAOYSA-N
MW170.22 g/mol
LogP-0.82
Rot. Bonds4

About N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine

N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine (PubChem CID 63152406) has the molecular formula C6H14N6 and a molecular weight of 170.22 g/mol. Its IUPAC name is N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine
PubChem CID63152406
Molecular FormulaC6H14N6
Molecular Weight170.22 g/mol
Exact Mass170.13
IUPAC NameN',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine
SMILESCN(C)CCNc1nnnn1C
InChIInChI=1S/C6H14N6/c1-11(2)5-4-7-6-8-9-10-12(6)3/h4-5H2,1-3H3,(H,7,8,10)
InChIKeyUOQZLSDMLCPIFR-UHFFFAOYSA-N
XLogP-0.82
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.22
LogP ≤ 5-0.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine?
The IUPAC name of N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine (CID 63152406) is N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine.
What is the SMILES notation for N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine?
The canonical SMILES for N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine is CN(C)CCNc1nnnn1C.
What is the InChIKey of N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine?
The InChIKey is UOQZLSDMLCPIFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N6/c1-11(2)5-4-7-6-8-9-10-12(6)3/h4-5H2,1-3H3,(H,7,8,10).
What are the key properties of N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine?
N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine has a molecular weight of 170.22 g/mol, XLogP of -0.82, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine is sourced from PubChem (CID 63152406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).