1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine

C12H17N3 — CID 87504345

IUPAC1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine
SMILESCNC1=CCN2C=CC=C(N(C)C)C2=C1
InChIInChI=1S/C12H17N3/c1-13-10-6-8-15-7-4-5-11(14(2)3)12(15)9-10/h4-7,9,13H,8H2,1-3H3
InChIKeyARSDKIJPPWMPLZ-UHFFFAOYSA-N
MW203.29 g/mol
LogP1.26
Rot. Bonds2

About 1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine

1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine (PubChem CID 87504345) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is 1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine.

Molecular Properties

Compound Name1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine
PubChem CID87504345
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC Name1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine
SMILESCNC1=CCN2C=CC=C(N(C)C)C2=C1
InChIInChI=1S/C12H17N3/c1-13-10-6-8-15-7-4-5-11(14(2)3)12(15)9-10/h4-7,9,13H,8H2,1-3H3
InChIKeyARSDKIJPPWMPLZ-UHFFFAOYSA-N
XLogP1.26
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine?
The IUPAC name of 1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine (CID 87504345) is 1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine.
What is the SMILES notation for 1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine?
The canonical SMILES for 1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine is CNC1=CCN2C=CC=C(N(C)C)C2=C1.
What is the InChIKey of 1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine?
The InChIKey is ARSDKIJPPWMPLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-13-10-6-8-15-7-4-5-11(14(2)3)12(15)9-10/h4-7,9,13H,8H2,1-3H3.
What are the key properties of 1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine?
1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine has a molecular weight of 203.29 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N,8-N-trimethyl-6H-quinolizine-1,8-diamine is sourced from PubChem (CID 87504345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).