N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine

C19H27N5O — CID 167853689

IUPACN-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine
SMILESCc1ccncc1CCCN1CCOC(CN(C)c2cccnn2)C1
InChIInChI=1S/C19H27N5O/c1-16-7-9-20-13-17(16)5-4-10-24-11-12-25-18(15-24)14-23(2)19-6-3-8-21-22-19/h3,6-9,13,18H,4-5,10-12,14-15H2,1-2H3
InChIKeyPRNJXCBBKDBKJA-UHFFFAOYSA-N
MW341.46 g/mol
LogP1.95
Rot. Bonds7

About N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine

N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine (PubChem CID 167853689) has the molecular formula C19H27N5O and a molecular weight of 341.46 g/mol. Its IUPAC name is N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine
PubChem CID167853689
Molecular FormulaC19H27N5O
Molecular Weight341.46 g/mol
Exact Mass341.22
IUPAC NameN-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine
SMILESCc1ccncc1CCCN1CCOC(CN(C)c2cccnn2)C1
InChIInChI=1S/C19H27N5O/c1-16-7-9-20-13-17(16)5-4-10-24-11-12-25-18(15-24)14-23(2)19-6-3-8-21-22-19/h3,6-9,13,18H,4-5,10-12,14-15H2,1-2H3
InChIKeyPRNJXCBBKDBKJA-UHFFFAOYSA-N
XLogP1.95
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The IUPAC name of N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine (CID 167853689) is N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine.
What is the SMILES notation for N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The canonical SMILES for N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine is Cc1ccncc1CCCN1CCOC(CN(C)c2cccnn2)C1.
What is the InChIKey of N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The InChIKey is PRNJXCBBKDBKJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O/c1-16-7-9-20-13-17(16)5-4-10-24-11-12-25-18(15-24)14-23(2)19-6-3-8-21-22-19/h3,6-9,13,18H,4-5,10-12,14-15H2,1-2H3.
What are the key properties of N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine?
N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine has a molecular weight of 341.46 g/mol, XLogP of 1.95, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine is sourced from PubChem (CID 167853689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).