2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine

C14H22N2O — CID 102698687

IUPAC2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine
SMILESCOC(C)CNCC1CCNc2ccccc21
InChIInChI=1S/C14H22N2O/c1-11(17-2)9-15-10-12-7-8-16-14-6-4-3-5-13(12)14/h3-6,11-12,15-16H,7-10H2,1-2H3
InChIKeyAVMUPPPRUOIFDY-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.21
Rot. Bonds5

About 2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine

2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine (PubChem CID 102698687) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine
PubChem CID102698687
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine
SMILESCOC(C)CNCC1CCNc2ccccc21
InChIInChI=1S/C14H22N2O/c1-11(17-2)9-15-10-12-7-8-16-14-6-4-3-5-13(12)14/h3-6,11-12,15-16H,7-10H2,1-2H3
InChIKeyAVMUPPPRUOIFDY-UHFFFAOYSA-N
XLogP2.21
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-2-propan-2-yl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)butan-1-amine
CID 102913688
N-methyl-1-(1,2,3,4-tetrahydroquinolin-4-yl)methanamine;hydrochloride
CID 165145771
N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)acetamide
CID 165439324
4-(bromomethyl)-1,2,3,4-tetrahydroquinoline
CID 119093179
2-methyl-N-[(8-methyl-1,2,3,4-tetrahydroquinolin-4-yl)methyl]propan-1-amine
CID 105491940
4-(4-methoxybutan-2-yl)-1,2,3,4-tetrahydroquinoline
CID 106781291
4-[(2-methoxyphenyl)methyl]-1,2,3,4-tetrahydroquinoline
CID 63868794
2-methyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)prop-2-enamide
CID 165439492
N-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine
CID 114277135
(4R)-1,2,3,4-tetrahydroquinolin-4-amine
CID 29243671
4-(ethylsulfonylmethyl)-1,2,3,4-tetrahydroquinoline
CID 115104486
4-methoxy-1,2,3,4-tetrahydroquinoline
CID 82275496

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine?
The IUPAC name of 2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine (CID 102698687) is 2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine.
What is the SMILES notation for 2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine?
The canonical SMILES for 2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine is COC(C)CNCC1CCNc2ccccc21.
What is the InChIKey of 2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine?
The InChIKey is AVMUPPPRUOIFDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11(17-2)9-15-10-12-7-8-16-14-6-4-3-5-13(12)14/h3-6,11-12,15-16H,7-10H2,1-2H3.
What are the key properties of 2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine?
2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine has a molecular weight of 234.34 g/mol, XLogP of 2.21, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)propan-1-amine is sourced from PubChem (CID 102698687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).