1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine

C22H20N4 — CID 3700701

IUPAC1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine
SMILESc1ccc(CN(Cc2cnc3ccccc3c2)Cc2ccccn2)nc1
InChIInChI=1S/C22H20N4/c1-2-10-22-19(7-1)13-18(14-25-22)15-26(16-20-8-3-5-11-23-20)17-21-9-4-6-12-24-21/h1-14H,15-17H2
InChIKeyDSCNYECJAWPKFM-UHFFFAOYSA-N
MW340.43 g/mol
LogP4.23
Rot. Bonds6

About 1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine

1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine (PubChem CID 3700701) has the molecular formula C22H20N4 and a molecular weight of 340.43 g/mol. Its IUPAC name is 1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine.

Molecular Properties

Compound Name1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine
PubChem CID3700701
Molecular FormulaC22H20N4
Molecular Weight340.43 g/mol
Exact Mass340.17
IUPAC Name1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine
SMILESc1ccc(CN(Cc2cnc3ccccc3c2)Cc2ccccn2)nc1
InChIInChI=1S/C22H20N4/c1-2-10-22-19(7-1)13-18(14-25-22)15-26(16-20-8-3-5-11-23-20)17-21-9-4-6-12-24-21/h1-14H,15-17H2
InChIKeyDSCNYECJAWPKFM-UHFFFAOYSA-N
XLogP4.23
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

copper;1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 130339696
N-[[3,5-bis[[benzyl(pyridin-2-ylmethyl)amino]methyl]phenyl]methyl]-1-phenyl-N-(pyridin-2-ylmethyl)methanamine
CID 101191424
N-[[6-[6-[[benzyl(pyridin-2-ylmethyl)amino]methyl]-2-pyridinyl]-2-pyridinyl]methyl]-1-phenyl-N-(pyridin-2-ylmethyl)methanamine
CID 91221880
N-[[5-[[bis(pyridin-2-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-2-pyridin-2-yl-N-(2-pyridin-2-ylethyl)ethanamine
CID 101335299
1-[2-[[bis(pyridin-2-ylmethyl)amino]methyl]phenyl]-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 54154120
bis(N-(anthracen-9-ylmethyl)-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine);cobalt
CID 10079223
1-[5-[[6-[[bis(pyridin-2-ylmethyl)amino]methyl]-3-pyridinyl]methoxymethyl]-2-pyridinyl]-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 10312778
6-[[(6-amino-2-pyridinyl)methyl-[[3-[[bis(pyridin-2-ylmethyl)amino]methyl]phenyl]methyl]amino]methyl]pyridin-2-amine
CID 44598597
1-[3-[[bis[(6-bromo-2-pyridinyl)methyl]amino]methyl]phenyl]-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 44598640
2-quinolin-3-ylethanol
CID 53403774
3-ethylquinoline;quinoline
CID 174966721
N'-(2-phenylethyl)-N'-(quinolin-3-ylmethyl)ethane-1,2-diamine;hydrochloride
CID 120912617

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine?
The IUPAC name of 1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine (CID 3700701) is 1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine.
What is the SMILES notation for 1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine?
The canonical SMILES for 1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine is c1ccc(CN(Cc2cnc3ccccc3c2)Cc2ccccn2)nc1.
What is the InChIKey of 1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine?
The InChIKey is DSCNYECJAWPKFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4/c1-2-10-22-19(7-1)13-18(14-25-22)15-26(16-20-8-3-5-11-23-20)17-21-9-4-6-12-24-21/h1-14H,15-17H2.
What are the key properties of 1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine?
1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine has a molecular weight of 340.43 g/mol, XLogP of 4.23, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-2-yl-N-(pyridin-2-ylmethyl)-N-(quinolin-3-ylmethyl)methanamine is sourced from PubChem (CID 3700701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).