2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine

C8H17N5 — CID 107049249

IUPAC2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine
SMILESCn1nnc(CCNC(C)(C)C)n1
InChIInChI=1S/C8H17N5/c1-8(2,3)9-6-5-7-10-12-13(4)11-7/h9H,5-6H2,1-4H3
InChIKeyWHAKPOJKHPJVOA-UHFFFAOYSA-N
MW183.26 g/mol
LogP0.14
Rot. Bonds3

About 2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine

2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine (PubChem CID 107049249) has the molecular formula C8H17N5 and a molecular weight of 183.26 g/mol. Its IUPAC name is 2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine
PubChem CID107049249
Molecular FormulaC8H17N5
Molecular Weight183.26 g/mol
Exact Mass183.15
IUPAC Name2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine
SMILESCn1nnc(CCNC(C)(C)C)n1
InChIInChI=1S/C8H17N5/c1-8(2,3)9-6-5-7-10-12-13(4)11-7/h9H,5-6H2,1-4H3
InChIKeyWHAKPOJKHPJVOA-UHFFFAOYSA-N
XLogP0.14
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.26
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-tert-butyl-N'-methyl-N'-[(2-methyltetrazol-5-yl)methyl]ethane-1,2-diamine
CID 107043617
N-tert-butyl-2-[(2-methyltetrazol-5-yl)methyl]pentan-1-amine
CID 107052906
N-tert-butyl-2-cyclopropyl-2-methyl-3-(2-methyltetrazol-5-yl)propan-1-amine
CID 107053545
N-ethyl-3,3-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]butan-1-amine
CID 107053527
4-bromo-2-methyl-N-[(2-methyltetrazol-5-yl)methyl]butan-2-amine
CID 107054210
N-tert-butyl-2-(2-methyltetrazol-5-yl)acetamide
CID 59768448
tert-butyl N-[(2-methyltetrazol-5-yl)methyl]carbamate
CID 45092164
(E)-N-ethyl-5-(2-methyltetrazol-5-yl)pent-3-en-1-amine
CID 107058714
2-methyl-N-[2-(3-methylphenyl)-3-(2-methyltetrazol-5-yl)propyl]propan-2-amine
CID 107053332
4-fluoro-N-[(2-methyltetrazol-5-yl)methyl]aniline
CID 69215565
2,3,3-trimethyl-N-[(2-methyltetrazol-5-yl)methyl]butan-1-amine
CID 107042638
N,N-dimethyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 910865

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine (CID 107049249) is 2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine is Cn1nnc(CCNC(C)(C)C)n1.
What is the InChIKey of 2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine?
The InChIKey is WHAKPOJKHPJVOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N5/c1-8(2,3)9-6-5-7-10-12-13(4)11-7/h9H,5-6H2,1-4H3.
What are the key properties of 2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine?
2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine has a molecular weight of 183.26 g/mol, XLogP of 0.14, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(2-methyltetrazol-5-yl)ethyl]propan-2-amine is sourced from PubChem (CID 107049249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).