1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine

C9H18N6 — CID 79034136

IUPAC1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine
SMILESCC1CC(Nc2nnnn2C)CCN1C
InChIInChI=1S/C9H18N6/c1-7-6-8(4-5-14(7)2)10-9-11-12-13-15(9)3/h7-8H,4-6H2,1-3H3,(H,10,11,13)
InChIKeyOOKNRORIURPIAX-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.10
Rot. Bonds2

About 1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine

1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine (PubChem CID 79034136) has the molecular formula C9H18N6 and a molecular weight of 210.28 g/mol. Its IUPAC name is 1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine.

Molecular Properties

Compound Name1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine
PubChem CID79034136
Molecular FormulaC9H18N6
Molecular Weight210.28 g/mol
Exact Mass210.16
IUPAC Name1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine
SMILESCC1CC(Nc2nnnn2C)CCN1C
InChIInChI=1S/C9H18N6/c1-7-6-8(4-5-14(7)2)10-9-11-12-13-15(9)3/h7-8H,4-6H2,1-3H3,(H,10,11,13)
InChIKeyOOKNRORIURPIAX-UHFFFAOYSA-N
XLogP0.10
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine?
The IUPAC name of 1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine (CID 79034136) is 1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine.
What is the SMILES notation for 1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine?
The canonical SMILES for 1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine is CC1CC(Nc2nnnn2C)CCN1C.
What is the InChIKey of 1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine?
The InChIKey is OOKNRORIURPIAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N6/c1-7-6-8(4-5-14(7)2)10-9-11-12-13-15(9)3/h7-8H,4-6H2,1-3H3,(H,10,11,13).
What are the key properties of 1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine?
1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine has a molecular weight of 210.28 g/mol, XLogP of 0.10, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine is sourced from PubChem (CID 79034136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).