N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine

C12H23N5 — CID 79350352

IUPACN-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine
SMILESCC(C)NCc1nnnn1C1C(C)(C)C1(C)C
InChIInChI=1S/C12H23N5/c1-8(2)13-7-9-14-15-16-17(9)10-11(3,4)12(10,5)6/h8,10,13H,7H2,1-6H3
InChIKeyOZWJIJUPNLJCAZ-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.78
Rot. Bonds4

About N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine

N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine (PubChem CID 79350352) has the molecular formula C12H23N5 and a molecular weight of 237.35 g/mol. Its IUPAC name is N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine
PubChem CID79350352
Molecular FormulaC12H23N5
Molecular Weight237.35 g/mol
Exact Mass237.20
IUPAC NameN-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine
SMILESCC(C)NCc1nnnn1C1C(C)(C)C1(C)C
InChIInChI=1S/C12H23N5/c1-8(2)13-7-9-14-15-16-17(9)10-11(3,4)12(10,5)6/h8,10,13H,7H2,1-6H3
InChIKeyOZWJIJUPNLJCAZ-UHFFFAOYSA-N
XLogP1.78
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine
CID 62763307
N-[[1-(oxolan-3-yl)tetrazol-5-yl]methyl]propan-2-amine
CID 80715224
N-[[1-(2-ethylsulfanylcyclopentyl)tetrazol-5-yl]methyl]propan-2-amine
CID 114121872
N-[[1-(7-oxabicyclo[2.2.1]heptan-2-yl)tetrazol-5-yl]methyl]propan-2-amine
CID 80732011
N-(2-methoxyethyl)-1-[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]ethanamine
CID 103086509
N-[[1-(2-methylbutan-2-yl)tetrazol-5-yl]methyl]propan-2-amine
CID 62737236
N-[[1-(2,6-dibromophenyl)tetrazol-5-yl]methyl]propan-2-amine
CID 107603620
1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-amine
CID 79506517
N-[[1-[(1-ethylcyclopentyl)methyl]tetrazol-5-yl]methyl]propan-2-amine
CID 114125134
N-[[1-[(2-methylcyclopentyl)methyl]tetrazol-5-yl]methyl]propan-2-amine
CID 107420733
N-[[1-(2-phenylethyl)tetrazol-5-yl]methyl]propan-2-amine
CID 62736869
N-[[1-(3,3,3-trifluoropropyl)tetrazol-5-yl]methyl]propan-2-amine
CID 63228032

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine?
The IUPAC name of N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine (CID 79350352) is N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine is CC(C)NCc1nnnn1C1C(C)(C)C1(C)C.
What is the InChIKey of N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine?
The InChIKey is OZWJIJUPNLJCAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N5/c1-8(2)13-7-9-14-15-16-17(9)10-11(3,4)12(10,5)6/h8,10,13H,7H2,1-6H3.
What are the key properties of N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine?
N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine has a molecular weight of 237.35 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine is sourced from PubChem (CID 79350352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).