N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine

C16H25N3 — CID 81214759

IUPACN-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine
SMILESCN1CCC(N(C)c2ccc3c(c2)NCCC3)CC1
InChIInChI=1S/C16H25N3/c1-18-10-7-14(8-11-18)19(2)15-6-5-13-4-3-9-17-16(13)12-15/h5-6,12,14,17H,3-4,7-11H2,1-2H3
InChIKeyVRDLFBAVQAESLG-UHFFFAOYSA-N
MW259.40 g/mol
LogP2.58
Rot. Bonds2

About N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine

N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine (PubChem CID 81214759) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine.

Molecular Properties

Compound NameN-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine
PubChem CID81214759
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC NameN-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine
SMILESCN1CCC(N(C)c2ccc3c(c2)NCCC3)CC1
InChIInChI=1S/C16H25N3/c1-18-10-7-14(8-11-18)19(2)15-6-5-13-4-3-9-17-16(13)12-15/h5-6,12,14,17H,3-4,7-11H2,1-2H3
InChIKeyVRDLFBAVQAESLG-UHFFFAOYSA-N
XLogP2.58
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine?
The IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine (CID 81214759) is N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine.
What is the SMILES notation for N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine?
The canonical SMILES for N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine is CN1CCC(N(C)c2ccc3c(c2)NCCC3)CC1.
What is the InChIKey of N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine?
The InChIKey is VRDLFBAVQAESLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-18-10-7-14(8-11-18)19(2)15-6-5-13-4-3-9-17-16(13)12-15/h5-6,12,14,17H,3-4,7-11H2,1-2H3.
What are the key properties of N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine?
N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine has a molecular weight of 259.40 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinolin-7-amine is sourced from PubChem (CID 81214759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).