N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine

C23H28N4 — CID 50980716

IUPACN-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine
SMILESCc1ccc(C2(CN(C)Cc3ccc4ccccc4n3)CCNCC2)nc1
InChIInChI=1S/C23H28N4/c1-18-7-10-22(25-15-18)23(11-13-24-14-12-23)17-27(2)16-20-9-8-19-5-3-4-6-21(19)26-20/h3-10,15,24H,11-14,16-17H2,1-2H3
InChIKeyVEMYSOREZBHIMN-UHFFFAOYSA-N
MW360.51 g/mol
LogP3.69
Rot. Bonds5

About N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine

N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine (PubChem CID 50980716) has the molecular formula C23H28N4 and a molecular weight of 360.51 g/mol. Its IUPAC name is N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine.

Molecular Properties

Compound NameN-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine
PubChem CID50980716
Molecular FormulaC23H28N4
Molecular Weight360.51 g/mol
Exact Mass360.23
IUPAC NameN-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine
SMILESCc1ccc(C2(CN(C)Cc3ccc4ccccc4n3)CCNCC2)nc1
InChIInChI=1S/C23H28N4/c1-18-7-10-22(25-15-18)23(11-13-24-14-12-23)17-27(2)16-20-9-8-19-5-3-4-6-21(19)26-20/h3-10,15,24H,11-14,16-17H2,1-2H3
InChIKeyVEMYSOREZBHIMN-UHFFFAOYSA-N
XLogP3.69
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.51
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine with MolForge

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Related Compounds

N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-(3-methylthiophen-2-yl)methanamine;dihydrochloride
CID 154889541
1-(2,1,3-benzothiadiazol-5-yl)-N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]methanamine;dihydrochloride
CID 154890940
1-[(2S)-2,3-dihydro-1-benzofuran-2-yl]-N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]methanamine
CID 95129547
1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol
CID 115758417
N-methyl-N-[[5-[[methyl(quinolin-2-ylmethyl)amino]methyl]pyrazin-2-yl]methyl]-1-quinolin-2-ylmethanamine
CID 74539424
4-[[methyl-[(5-methyl-2-pyridinyl)methyl]amino]methyl]-1-oxa-9-azaspiro[5.5]undecan-4-ol;hydrochloride
CID 171152310
N-methyl-N-(quinolin-2-ylmethyl)propan-1-amine
CID 138692452
(1R,2R)-1-[methyl(quinolin-2-ylmethyl)amino]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
CID 31193627
N-methyl-N-[(4-phenylpiperidin-4-yl)methyl]-1-(1,3-thiazol-4-yl)methanamine
CID 63155065
2-methyl-1-[methyl(quinolin-2-ylmethyl)amino]propan-2-ol
CID 78995605
N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride
CID 119923035
N-propan-2-yl-N-(quinolin-2-ylmethyl)propan-2-amine
CID 20687195

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine?
The IUPAC name of N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine (CID 50980716) is N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine.
What is the SMILES notation for N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine?
The canonical SMILES for N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine is Cc1ccc(C2(CN(C)Cc3ccc4ccccc4n3)CCNCC2)nc1.
What is the InChIKey of N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine?
The InChIKey is VEMYSOREZBHIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4/c1-18-7-10-22(25-15-18)23(11-13-24-14-12-23)17-27(2)16-20-9-8-19-5-3-4-6-21(19)26-20/h3-10,15,24H,11-14,16-17H2,1-2H3.
What are the key properties of N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine?
N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine has a molecular weight of 360.51 g/mol, XLogP of 3.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine is sourced from PubChem (CID 50980716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).