N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine

C22H19N3O2 — CID 56707589

IUPACN-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine
SMILESCOc1ccccc1Oc1ncccc1CNc1ccnc2ccccc12
InChIInChI=1S/C22H19N3O2/c1-26-20-10-4-5-11-21(20)27-22-16(7-6-13-24-22)15-25-19-12-14-23-18-9-3-2-8-17(18)19/h2-14H,15H2,1H3,(H,23,25)
InChIKeyKVZAHYZFCAAAFJ-UHFFFAOYSA-N
MW357.41 g/mol
LogP5.04
Rot. Bonds6

About N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine

N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine (PubChem CID 56707589) has the molecular formula C22H19N3O2 and a molecular weight of 357.41 g/mol. Its IUPAC name is N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine.

Molecular Properties

Compound NameN-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine
PubChem CID56707589
Molecular FormulaC22H19N3O2
Molecular Weight357.41 g/mol
Exact Mass357.15
IUPAC NameN-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine
SMILESCOc1ccccc1Oc1ncccc1CNc1ccnc2ccccc12
InChIInChI=1S/C22H19N3O2/c1-26-20-10-4-5-11-21(20)27-22-16(7-6-13-24-22)15-25-19-12-14-23-18-9-3-2-8-17(18)19/h2-14H,15H2,1H3,(H,23,25)
InChIKeyKVZAHYZFCAAAFJ-UHFFFAOYSA-N
XLogP5.04
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.41
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[2-[(quinolin-4-ylamino)methyl]phenyl]methyl]quinolin-4-amine
CID 67723222
N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]acetamide
CID 42198309
4-methoxy-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]pyrimidin-2-amine
CID 56744605
N-[(2,4-difluorophenyl)methyl]quinolin-4-amine
CID 62227376
N-[(2-methoxy-3-pyridinyl)methyl]-1,2,4-benzotriazin-3-amine
CID 103204100
N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinoline-6-carboxamide
CID 56738127
N-ethylquinolin-4-amine
CID 15306588
(2S)-2-hydroxy-N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]butanamide
CID 95206608
3-[(quinolin-5-ylamino)methyl]benzene-1,2-diol
CID 61317236
1-(2,3-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]methanamine
CID 60761596
N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]furan-3-carboxamide
CID 26409085
(3R)-N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]-1-azabicyclo[2.2.2]octan-3-amine
CID 95228435

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine?
The IUPAC name of N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine (CID 56707589) is N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine.
What is the SMILES notation for N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine?
The canonical SMILES for N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine is COc1ccccc1Oc1ncccc1CNc1ccnc2ccccc12.
What is the InChIKey of N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine?
The InChIKey is KVZAHYZFCAAAFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O2/c1-26-20-10-4-5-11-21(20)27-22-16(7-6-13-24-22)15-25-19-12-14-23-18-9-3-2-8-17(18)19/h2-14H,15H2,1H3,(H,23,25).
What are the key properties of N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine?
N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine has a molecular weight of 357.41 g/mol, XLogP of 5.04, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]quinolin-4-amine is sourced from PubChem (CID 56707589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).