N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine

C10H19N5 — CID 62737264

IUPACN-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine
SMILESCC(C)C(C)n1nnnc1CNC1CC1
InChIInChI=1S/C10H19N5/c1-7(2)8(3)15-10(12-13-14-15)6-11-9-4-5-9/h7-9,11H,4-6H2,1-3H3
InChIKeyNGLVZIBAJYRYOV-UHFFFAOYSA-N
MW209.30 g/mol
LogP1.14
Rot. Bonds5

About N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine

N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine (PubChem CID 62737264) has the molecular formula C10H19N5 and a molecular weight of 209.30 g/mol. Its IUPAC name is N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine
PubChem CID62737264
Molecular FormulaC10H19N5
Molecular Weight209.30 g/mol
Exact Mass209.16
IUPAC NameN-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine
SMILESCC(C)C(C)n1nnnc1CNC1CC1
InChIInChI=1S/C10H19N5/c1-7(2)8(3)15-10(12-13-14-15)6-11-9-4-5-9/h7-9,11H,4-6H2,1-3H3
InChIKeyNGLVZIBAJYRYOV-UHFFFAOYSA-N
XLogP1.14
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.30
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine (CID 62737264) is N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine is CC(C)C(C)n1nnnc1CNC1CC1.
What is the InChIKey of N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine?
The InChIKey is NGLVZIBAJYRYOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5/c1-7(2)8(3)15-10(12-13-14-15)6-11-9-4-5-9/h7-9,11H,4-6H2,1-3H3.
What are the key properties of N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine?
N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine has a molecular weight of 209.30 g/mol, XLogP of 1.14, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62737264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).