N'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine

C5H12N6 — CID 130589957

IUPACN'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine
SMILESCN(CCN)Cc1nn[nH]n1
InChIInChI=1S/C5H12N6/c1-11(3-2-6)4-5-7-9-10-8-5/h2-4,6H2,1H3,(H,7,8,9,10)
InChIKeySVCDGKBTSPDDAE-UHFFFAOYSA-N
MW156.19 g/mol
LogP-1.41
Rot. Bonds4

About N'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine

N'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine (PubChem CID 130589957) has the molecular formula C5H12N6 and a molecular weight of 156.19 g/mol. Its IUPAC name is N'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine
PubChem CID130589957
Molecular FormulaC5H12N6
Molecular Weight156.19 g/mol
Exact Mass156.11
IUPAC NameN'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine
SMILESCN(CCN)Cc1nn[nH]n1
InChIInChI=1S/C5H12N6/c1-11(3-2-6)4-5-7-9-10-8-5/h2-4,6H2,1H3,(H,7,8,9,10)
InChIKeySVCDGKBTSPDDAE-UHFFFAOYSA-N
XLogP-1.41
TPSA83.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-1.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol
CID 130161885
N,N-dimethyl-1-(2H-tetrazol-5-yl)methanamine
CID 14787295
N'-benzyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine
CID 130589983
2H-tetrazol-5-ylmethanamine
CID 5146781
N'-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N'-methylethane-1,2-diamine
CID 62687933
2-tert-butyl-N-methyl-N-(2H-tetrazol-5-ylmethyl)benzamide
CID 146127109
lanthanum;tris(2-(2H-tetrazol-5-yl)acetic acid)
CID 156633731
CID 174337879
CID 174337879
1-amino-6-(2H-tetrazol-5-yl)hexan-3-one
CID 167706452
N'-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-N'-methylethane-1,2-diamine
CID 62687751
N'-methyl-N'-(pyrimidin-2-ylmethyl)propane-1,3-diamine
CID 62700832
2-[methyl-[2-(2H-tetrazol-5-yl)acetyl]amino]acetic acid
CID 110498043

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine?
The IUPAC name of N'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine (CID 130589957) is N'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine?
The canonical SMILES for N'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine is CN(CCN)Cc1nn[nH]n1.
What is the InChIKey of N'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine?
The InChIKey is SVCDGKBTSPDDAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N6/c1-11(3-2-6)4-5-7-9-10-8-5/h2-4,6H2,1H3,(H,7,8,9,10).
What are the key properties of N'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine?
N'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine has a molecular weight of 156.19 g/mol, XLogP of -1.41, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N'-(2H-tetrazol-5-ylmethyl)ethane-1,2-diamine is sourced from PubChem (CID 130589957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).