N-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine

C10H19N5 — CID 62761510

IUPACN-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine
SMILESCC(C)(C)Cn1nnnc1CNC1CC1
InChIInChI=1S/C10H19N5/c1-10(2,3)7-15-9(12-13-14-15)6-11-8-4-5-8/h8,11H,4-7H2,1-3H3
InChIKeyAEDIESJBEGDOPT-UHFFFAOYSA-N
MW209.30 g/mol
LogP0.97
Rot. Bonds4

About N-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine

N-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine (PubChem CID 62761510) has the molecular formula C10H19N5 and a molecular weight of 209.30 g/mol. Its IUPAC name is N-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine
PubChem CID62761510
Molecular FormulaC10H19N5
Molecular Weight209.30 g/mol
Exact Mass209.16
IUPAC NameN-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine
SMILESCC(C)(C)Cn1nnnc1CNC1CC1
InChIInChI=1S/C10H19N5/c1-10(2,3)7-15-9(12-13-14-15)6-11-8-4-5-8/h8,11H,4-7H2,1-3H3
InChIKeyAEDIESJBEGDOPT-UHFFFAOYSA-N
XLogP0.97
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.30
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[1-(2-cyclopentylethyl)tetrazol-5-yl]methyl]cyclopropanamine
CID 62737833
N-[[1-[(4-methylcyclohexyl)methyl]tetrazol-5-yl]methyl]cyclopropanamine
CID 63243927
N-[[1-(2-cyclohexylethyl)tetrazol-5-yl]methyl]cyclopropanamine
CID 62735610
N-[[1-[(2-methylcyclohexyl)methyl]tetrazol-5-yl]methyl]cyclopropanamine
CID 62762045
N-[[1-(2-propan-2-yloxyethyl)tetrazol-5-yl]methyl]cyclopropanamine
CID 104766007
N-[[1-(2-cyclohexyloxyethyl)tetrazol-5-yl]methyl]cyclopropanamine
CID 63827261
N-[[1-[(3-chlorophenyl)methyl]tetrazol-5-yl]methyl]cyclopropanamine
CID 62735968
N-[[1-(oxan-2-ylmethyl)tetrazol-5-yl]methyl]cyclopropanamine
CID 62763114
N-[[1-(3-methylbutan-2-yl)tetrazol-5-yl]methyl]cyclopropanamine
CID 62737264
N-[[1-[(4-methylsulfonylphenyl)methyl]tetrazol-5-yl]methyl]cyclopropanamine
CID 62763500
N-[[1-[(3-chloro-4-fluorophenyl)methyl]tetrazol-5-yl]methyl]cyclopropanamine
CID 62735977
N-[[1-(naphthalen-1-ylmethyl)tetrazol-5-yl]methyl]cyclopropanamine
CID 62762574

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine (CID 62761510) is N-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine is CC(C)(C)Cn1nnnc1CNC1CC1.
What is the InChIKey of N-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine?
The InChIKey is AEDIESJBEGDOPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5/c1-10(2,3)7-15-9(12-13-14-15)6-11-8-4-5-8/h8,11H,4-7H2,1-3H3.
What are the key properties of N-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine?
N-[[1-(2,2-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine has a molecular weight of 209.30 g/mol, XLogP of 0.97, 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-dimethylpropyl)tetrazol-5-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62761510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).