2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine

C10H21N5 — CID 107053101

IUPAC2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine
SMILESCC(C)NCC(C)(C)Cc1nnn(C)n1
InChIInChI=1S/C10H21N5/c1-8(2)11-7-10(3,4)6-9-12-14-15(5)13-9/h8,11H,6-7H2,1-5H3
InChIKeySWFANJABTHQMOJ-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.78
Rot. Bonds5

About 2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine

2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine (PubChem CID 107053101) has the molecular formula C10H21N5 and a molecular weight of 211.31 g/mol. Its IUPAC name is 2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine
PubChem CID107053101
Molecular FormulaC10H21N5
Molecular Weight211.31 g/mol
Exact Mass211.18
IUPAC Name2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine
SMILESCC(C)NCC(C)(C)Cc1nnn(C)n1
InChIInChI=1S/C10H21N5/c1-8(2)11-7-10(3,4)6-9-12-14-15(5)13-9/h8,11H,6-7H2,1-5H3
InChIKeySWFANJABTHQMOJ-UHFFFAOYSA-N
XLogP0.78
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine?
The IUPAC name of 2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine (CID 107053101) is 2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for 2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine?
The canonical SMILES for 2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine is CC(C)NCC(C)(C)Cc1nnn(C)n1.
What is the InChIKey of 2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine?
The InChIKey is SWFANJABTHQMOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N5/c1-8(2)11-7-10(3,4)6-9-12-14-15(5)13-9/h8,11H,6-7H2,1-5H3.
What are the key properties of 2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine?
2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine has a molecular weight of 211.31 g/mol, XLogP of 0.78, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-(2-methyltetrazol-5-yl)-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 107053101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).