N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine

C17H27N3 — CID 106901995

IUPACN,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine
SMILESCN(C)C1CCN(CC2CNc3ccccc3C2)CC1
InChIInChI=1S/C17H27N3/c1-19(2)16-7-9-20(10-8-16)13-14-11-15-5-3-4-6-17(15)18-12-14/h3-6,14,16,18H,7-13H2,1-2H3
InChIKeyDCKVLZZPLKUQLP-UHFFFAOYSA-N
MW273.42 g/mol
LogP2.30
Rot. Bonds3

About N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine

N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine (PubChem CID 106901995) has the molecular formula C17H27N3 and a molecular weight of 273.42 g/mol. Its IUPAC name is N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine
PubChem CID106901995
Molecular FormulaC17H27N3
Molecular Weight273.42 g/mol
Exact Mass273.22
IUPAC NameN,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine
SMILESCN(C)C1CCN(CC2CNc3ccccc3C2)CC1
InChIInChI=1S/C17H27N3/c1-19(2)16-7-9-20(10-8-16)13-14-11-15-5-3-4-6-17(15)18-12-14/h3-6,14,16,18H,7-13H2,1-2H3
InChIKeyDCKVLZZPLKUQLP-UHFFFAOYSA-N
XLogP2.30
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(azetidin-1-ylmethyl)-1,2,3,4-tetrahydroquinoline
CID 105454799
(3S)-3-(pyrrolidin-1-ylmethyl)-1,2,3,4-tetrahydroquinoline
CID 70239123
3-[(4-methylazepan-1-yl)methyl]-1,2,3,4-tetrahydroquinoline
CID 106902202
3-[(4-propan-2-ylazepan-1-yl)methyl]-1,2,3,4-tetrahydroquinoline
CID 106902225
3-[(4-propylpiperazin-1-yl)methyl]-1,2,3,4-tetrahydroquinoline
CID 106901956
N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-yl)piperidin-4-amine
CID 54861271
3-(8-azaspiro[4.5]decan-8-ylmethyl)-1,2,3,4-tetrahydroquinoline
CID 106902182
N-methyl-2-pyrrolidin-1-yl-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)ethanamine
CID 106902191
N-methyl-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)propan-2-amine
CID 106901949
(3S)-N,N-dimethyl-2,3,4,5-tetrahydro-1H-1-benzazepin-3-amine
CID 124681115
3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,3,4-tetrahydroquinoline
CID 106902175
N,3-dimethyl-N-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)cyclohexan-1-amine
CID 106902062

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine?
The IUPAC name of N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine (CID 106901995) is N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine.
What is the SMILES notation for N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine?
The canonical SMILES for N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine is CN(C)C1CCN(CC2CNc3ccccc3C2)CC1.
What is the InChIKey of N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine?
The InChIKey is DCKVLZZPLKUQLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3/c1-19(2)16-7-9-20(10-8-16)13-14-11-15-5-3-4-6-17(15)18-12-14/h3-6,14,16,18H,7-13H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine?
N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine has a molecular weight of 273.42 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 106901995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).