N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine

C18H25N3 — CID 63854973

IUPACN-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine
SMILESCNC(C)C1CCCN(Cc2cccc3cccnc23)C1
InChIInChI=1S/C18H25N3/c1-14(19-2)16-9-5-11-21(12-16)13-17-7-3-6-15-8-4-10-20-18(15)17/h3-4,6-8,10,14,16,19H,5,9,11-13H2,1-2H3
InChIKeyZHFDBYHEDIATCQ-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.05
Rot. Bonds4

About N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine

N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine (PubChem CID 63854973) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine
PubChem CID63854973
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC NameN-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine
SMILESCNC(C)C1CCCN(Cc2cccc3cccnc23)C1
InChIInChI=1S/C18H25N3/c1-14(19-2)16-9-5-11-21(12-16)13-17-7-3-6-15-8-4-10-20-18(15)17/h3-4,6-8,10,14,16,19H,5,9,11-13H2,1-2H3
InChIKeyZHFDBYHEDIATCQ-UHFFFAOYSA-N
XLogP3.05
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-[1-(naphthalen-1-ylmethyl)piperidin-3-yl]ethanamine
CID 63854447
1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanone
CID 63845455
N-methyl-1-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethanamine
CID 55256845
N-[[1-(quinolin-8-ylmethyl)piperidin-3-yl]-(1,3-thiazol-2-yl)methyl]acetamide
CID 110215571
1-(quinolin-8-ylmethyl)piperidine-3-carboxylic acid
CID 43440675
N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine
CID 63854795
8-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)quinoline
CID 78945122
N-methyl-1-[1-(quinolin-2-ylmethyl)piperidin-3-yl]ethanamine
CID 63852699
N-propyl-1-(quinolin-8-ylmethyl)pyrrolidin-3-amine
CID 81427742
1-[(6-bromoquinolin-8-yl)methyl]-N-methylpiperidin-3-amine;dihydrochloride
CID 119919750
1-[1-[(2,5-dimethylphenyl)methyl]piperidin-3-yl]-N-methylethanamine
CID 63853047
1-[1-[(5-chloroquinolin-8-yl)methyl]piperidin-3-yl]ethanamine
CID 115741490

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine?
The IUPAC name of N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine (CID 63854973) is N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine.
What is the SMILES notation for N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine?
The canonical SMILES for N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine is CNC(C)C1CCCN(Cc2cccc3cccnc23)C1.
What is the InChIKey of N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine?
The InChIKey is ZHFDBYHEDIATCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-14(19-2)16-9-5-11-21(12-16)13-17-7-3-6-15-8-4-10-20-18(15)17/h3-4,6-8,10,14,16,19H,5,9,11-13H2,1-2H3.
What are the key properties of N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine?
N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine has a molecular weight of 283.42 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine is sourced from PubChem (CID 63854973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).