N,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine

C12H18N2 — CID 64989430

IUPACN,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine
SMILESCN(C)CC1CNCc2ccccc21
InChIInChI=1S/C12H18N2/c1-14(2)9-11-8-13-7-10-5-3-4-6-12(10)11/h3-6,11,13H,7-9H2,1-2H3
InChIKeyLDRDDIWVLGOPKF-UHFFFAOYSA-N
MW190.29 g/mol
LogP1.43
Rot. Bonds2

About N,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine

N,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine (PubChem CID 64989430) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is N,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine
PubChem CID64989430
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC NameN,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine
SMILESCN(C)CC1CNCc2ccccc21
InChIInChI=1S/C12H18N2/c1-14(2)9-11-8-13-7-10-5-3-4-6-12(10)11/h3-6,11,13H,7-9H2,1-2H3
InChIKeyLDRDDIWVLGOPKF-UHFFFAOYSA-N
XLogP1.43
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)propan-1-amine
CID 65262509
N-methyl-2-phenyl-N-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)ethanamine
CID 65486181
1-(7-fluoro-1,2,3,4-tetrahydroisoquinolin-4-yl)-N,N-dimethylmethanamine
CID 105462032
N-methyl-1-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)methanamine
CID 65262274
N-methyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)-N-(thiophen-3-ylmethyl)methanamine
CID 65261890
4-[(dimethylamino)methyl]-1,2,3,4-tetrahydroisoquinolin-8-ol
CID 105459336
N-(2-methylpropyl)-N-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)cyclopropanamine
CID 65262181
N-ethyl-N-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)cyclohexanamine
CID 65262124
N-(cyclopropylmethyl)-N-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)propan-1-amine
CID 65262416
4-(methylsulfonylmethyl)-1,2,3,4-tetrahydroisoquinoline
CID 115104290
N-(3-methylbutyl)-N-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)cyclopropanamine
CID 79005146
2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)propan-2-amine
CID 65262461

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine?
The IUPAC name of N,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine (CID 64989430) is N,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine?
The canonical SMILES for N,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine is CN(C)CC1CNCc2ccccc21.
What is the InChIKey of N,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine?
The InChIKey is LDRDDIWVLGOPKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-14(2)9-11-8-13-7-10-5-3-4-6-12(10)11/h3-6,11,13H,7-9H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine?
N,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine has a molecular weight of 190.29 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanamine is sourced from PubChem (CID 64989430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).