6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine

C20H22N6 — CID 97389766

IUPAC6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine
SMILESCc1ccc(NCc2cncc3c2CCN(Cc2ccccn2)C3)nn1
InChIInChI=1S/C20H22N6/c1-15-5-6-20(25-24-15)23-12-16-10-21-11-17-13-26(9-7-19(16)17)14-18-4-2-3-8-22-18/h2-6,8,10-11H,7,9,12-14H2,1H3,(H,23,25)
InChIKeyMEZFWCVKTODJKR-UHFFFAOYSA-N
MW346.44 g/mol
LogP2.75
Rot. Bonds5

About 6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine

6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine (PubChem CID 97389766) has the molecular formula C20H22N6 and a molecular weight of 346.44 g/mol. Its IUPAC name is 6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine.

Molecular Properties

Compound Name6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine
PubChem CID97389766
Molecular FormulaC20H22N6
Molecular Weight346.44 g/mol
Exact Mass346.19
IUPAC Name6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine
SMILESCc1ccc(NCc2cncc3c2CCN(Cc2ccccn2)C3)nn1
InChIInChI=1S/C20H22N6/c1-15-5-6-20(25-24-15)23-12-16-10-21-11-17-13-26(9-7-19(16)17)14-18-4-2-3-8-22-18/h2-6,8,10-11H,7,9,12-14H2,1H3,(H,23,25)
InChIKeyMEZFWCVKTODJKR-UHFFFAOYSA-N
XLogP2.75
TPSA66.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.44
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine with MolForge

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Related Compounds

furan-2-yl-[5-[[(6-methylpyridazin-3-yl)amino]methyl]-3,4-dihydro-1H-2,7-naphthyridin-2-yl]methanone
CID 97389767
6-methyl-N-[[7-[(3S)-oxolan-3-yl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine
CID 97389770
6-methyl-N-[[7-[(3R)-oxolan-3-yl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine
CID 97389769
5-(methoxymethyl)-2-(pyridin-2-ylmethyl)-3,4-dihydro-1H-2,7-naphthyridine;bis(2,2,2-trifluoroacetic acid)
CID 171692922
5-(pyridin-3-ylmethoxymethyl)-2-(pyridin-2-ylmethyl)-3,4-dihydro-1H-2,7-naphthyridine;bis(2,2,2-trifluoroacetic acid)
CID 171689858
5-(pyridin-3-ylmethoxymethyl)-2-(pyridin-2-ylmethyl)-3,4-dihydro-1H-2,7-naphthyridine;tetrakis(2,2,2-trifluoroacetic acid)
CID 155862215
2-methyl-N-[[7-(oxolan-3-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyrimidin-4-amine
CID 118742142
2-methyl-N-[[7-(oxolan-3-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyrimidin-4-amine;dihydrochloride
CID 118742141
5-(methoxymethyl)-2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-2,7-naphthyridine
CID 97381914
N-[(2-methoxy-3-pyridinyl)methyl]-6-methylpyridazin-3-amine
CID 61312329
7-(2-pyridin-2-ylacetyl)-6,8-dihydro-5H-2,7-naphthyridine-4-carboxylic acid
CID 112532701
N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]pyrimidin-2-amine
CID 97463946

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine?
The IUPAC name of 6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine (CID 97389766) is 6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine.
What is the SMILES notation for 6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine?
The canonical SMILES for 6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine is Cc1ccc(NCc2cncc3c2CCN(Cc2ccccn2)C3)nn1.
What is the InChIKey of 6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine?
The InChIKey is MEZFWCVKTODJKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N6/c1-15-5-6-20(25-24-15)23-12-16-10-21-11-17-13-26(9-7-19(16)17)14-18-4-2-3-8-22-18/h2-6,8,10-11H,7,9,12-14H2,1H3,(H,23,25).
What are the key properties of 6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine?
6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine has a molecular weight of 346.44 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]pyridazin-3-amine is sourced from PubChem (CID 97389766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).