2-(1-methyltetrazol-5-yl)pentan-3-amine

C7H15N5 — CID 63550008

IUPAC2-(1-methyltetrazol-5-yl)pentan-3-amine
SMILESCCC(N)C(C)c1nnnn1C
InChIInChI=1S/C7H15N5/c1-4-6(8)5(2)7-9-10-11-12(7)3/h5-6H,4,8H2,1-3H3
InChIKeyNIMWEEYWFCEJKG-UHFFFAOYSA-N
MW169.23 g/mol
LogP0.05
Rot. Bonds3

About 2-(1-methyltetrazol-5-yl)pentan-3-amine

2-(1-methyltetrazol-5-yl)pentan-3-amine (PubChem CID 63550008) has the molecular formula C7H15N5 and a molecular weight of 169.23 g/mol. Its IUPAC name is 2-(1-methyltetrazol-5-yl)pentan-3-amine.

Molecular Properties

Compound Name2-(1-methyltetrazol-5-yl)pentan-3-amine
PubChem CID63550008
Molecular FormulaC7H15N5
Molecular Weight169.23 g/mol
Exact Mass169.13
IUPAC Name2-(1-methyltetrazol-5-yl)pentan-3-amine
SMILESCCC(N)C(C)c1nnnn1C
InChIInChI=1S/C7H15N5/c1-4-6(8)5(2)7-9-10-11-12(7)3/h5-6H,4,8H2,1-3H3
InChIKeyNIMWEEYWFCEJKG-UHFFFAOYSA-N
XLogP0.05
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methyltetrazol-5-yl)pentan-3-amine?
The IUPAC name of 2-(1-methyltetrazol-5-yl)pentan-3-amine (CID 63550008) is 2-(1-methyltetrazol-5-yl)pentan-3-amine.
What is the SMILES notation for 2-(1-methyltetrazol-5-yl)pentan-3-amine?
The canonical SMILES for 2-(1-methyltetrazol-5-yl)pentan-3-amine is CCC(N)C(C)c1nnnn1C.
What is the InChIKey of 2-(1-methyltetrazol-5-yl)pentan-3-amine?
The InChIKey is NIMWEEYWFCEJKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N5/c1-4-6(8)5(2)7-9-10-11-12(7)3/h5-6H,4,8H2,1-3H3.
What are the key properties of 2-(1-methyltetrazol-5-yl)pentan-3-amine?
2-(1-methyltetrazol-5-yl)pentan-3-amine has a molecular weight of 169.23 g/mol, XLogP of 0.05, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyltetrazol-5-yl)pentan-3-amine is sourced from PubChem (CID 63550008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).