1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine

C8H15N5 — CID 107050394

IUPAC1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine
SMILESCn1nnc(CC(N)CC2CC2)n1
InChIInChI=1S/C8H15N5/c1-13-11-8(10-12-13)5-7(9)4-6-2-3-6/h6-7H,2-5,9H2,1H3
InChIKeyJDTICNWUODPLPW-UHFFFAOYSA-N
MW181.24 g/mol
LogP-0.12
Rot. Bonds4

About 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine

1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine (PubChem CID 107050394) has the molecular formula C8H15N5 and a molecular weight of 181.24 g/mol. Its IUPAC name is 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine
PubChem CID107050394
Molecular FormulaC8H15N5
Molecular Weight181.24 g/mol
Exact Mass181.13
IUPAC Name1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine
SMILESCn1nnc(CC(N)CC2CC2)n1
InChIInChI=1S/C8H15N5/c1-13-11-8(10-12-13)5-7(9)4-6-2-3-6/h6-7H,2-5,9H2,1H3
InChIKeyJDTICNWUODPLPW-UHFFFAOYSA-N
XLogP-0.12
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107049334
1-cyclohexyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107048433
1-(4-ethylcyclohexyl)-2-(2-methyltetrazol-5-yl)ethanol
CID 107047858
1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107064859
1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 131062453
1-(1,1-dioxothiolan-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107050587
1-cyclopentyl-3-(2-methyltetrazol-5-yl)propan-1-amine
CID 107044748
1-(4-tert-butylcyclohexyl)-2-(2-methyltetrazol-5-yl)ethanol
CID 107046399
2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine
CID 107049445
1-(4-butylcyclohexyl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107065022
1-(1-methoxycyclobutyl)-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107065522
[4-cyclopentyl-1-(2-methyltetrazol-5-yl)butan-2-yl]hydrazine
CID 107066854

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine?
The IUPAC name of 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine (CID 107050394) is 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine.
What is the SMILES notation for 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine?
The canonical SMILES for 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine is Cn1nnc(CC(N)CC2CC2)n1.
What is the InChIKey of 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine?
The InChIKey is JDTICNWUODPLPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5/c1-13-11-8(10-12-13)5-7(9)4-6-2-3-6/h6-7H,2-5,9H2,1H3.
What are the key properties of 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine?
1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine has a molecular weight of 181.24 g/mol, XLogP of -0.12, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine is sourced from PubChem (CID 107050394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).