1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine

C16H25N3 — CID 106024044

IUPAC1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine
SMILESCN1CCCC1CNCc1cccc2c1NCCC2
InChIInChI=1S/C16H25N3/c1-19-10-4-8-15(19)12-17-11-14-6-2-5-13-7-3-9-18-16(13)14/h2,5-6,15,17-18H,3-4,7-12H2,1H3
InChIKeyHZSAUGDEKHFGSY-UHFFFAOYSA-N
MW259.40 g/mol
LogP2.23
Rot. Bonds4

About 1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine

1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine (PubChem CID 106024044) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is 1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine
PubChem CID106024044
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC Name1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine
SMILESCN1CCCC1CNCc1cccc2c1NCCC2
InChIInChI=1S/C16H25N3/c1-19-10-4-8-15(19)12-17-11-14-6-2-5-13-7-3-9-18-16(13)14/h2,5-6,15,17-18H,3-4,7-12H2,1H3
InChIKeyHZSAUGDEKHFGSY-UHFFFAOYSA-N
XLogP2.23
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-methylpyrrolidin-3-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine
CID 80648401
3-[(1,2,3,4-tetrahydroquinolin-8-ylmethylamino)methyl]cyclobutan-1-ol
CID 80649380
N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-(1-methylpyrrolidin-3-yl)methanamine
CID 80650398
N-[(2-cyclopropylphenyl)methyl]-1-(1-methylpyrrolidin-2-yl)methanamine
CID 103739294
2-cyclobutyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)ethanamine
CID 113478618
3-pyrrolidin-1-yl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)propan-1-amine
CID 80648840
1-(2-bicyclo[2.2.1]heptanyl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine
CID 80648906
1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine
CID 114399580
2,3-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)butan-1-amine
CID 80649952
N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)propan-2-amine
CID 80648504
2-(1-methylimidazol-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)ethanamine
CID 80648410
1-pyridin-3-yl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine
CID 80648841

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine?
The IUPAC name of 1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine (CID 106024044) is 1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine.
What is the SMILES notation for 1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine?
The canonical SMILES for 1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine is CN1CCCC1CNCc1cccc2c1NCCC2.
What is the InChIKey of 1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine?
The InChIKey is HZSAUGDEKHFGSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-19-10-4-8-15(19)12-17-11-14-6-2-5-13-7-3-9-18-16(13)14/h2,5-6,15,17-18H,3-4,7-12H2,1H3.
What are the key properties of 1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine?
1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine has a molecular weight of 259.40 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpyrrolidin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine is sourced from PubChem (CID 106024044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).