N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine

C17H21FN4O2 — CID 71928034

IUPACN-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine
SMILESFc1ccccc1OCCN1CCOC(CNc2cccnn2)C1
InChIInChI=1S/C17H21FN4O2/c18-15-4-1-2-5-16(15)24-11-9-22-8-10-23-14(13-22)12-19-17-6-3-7-20-21-17/h1-7,14H,8-13H2,(H,19,21)
InChIKeySWBYGJNQFUBIPY-UHFFFAOYSA-N
MW332.38 g/mol
LogP1.81
Rot. Bonds7

About N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine

N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine (PubChem CID 71928034) has the molecular formula C17H21FN4O2 and a molecular weight of 332.38 g/mol. Its IUPAC name is N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine
PubChem CID71928034
Molecular FormulaC17H21FN4O2
Molecular Weight332.38 g/mol
Exact Mass332.16
IUPAC NameN-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine
SMILESFc1ccccc1OCCN1CCOC(CNc2cccnn2)C1
InChIInChI=1S/C17H21FN4O2/c18-15-4-1-2-5-16(15)24-11-9-22-8-10-23-14(13-22)12-19-17-6-3-7-20-21-17/h1-7,14H,8-13H2,(H,19,21)
InChIKeySWBYGJNQFUBIPY-UHFFFAOYSA-N
XLogP1.81
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.38
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[(2R)-4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512555
N-[[4-[2-(cyclohexylamino)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872217
N-[[4-(2-methylsulfonylethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872271
N-[[(2R)-4-(2-thiophen-2-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512563
N-[[(2R)-4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512573
N-[[4-[(5-methyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872216
N-propan-2-yl-3-[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propanamide
CID 96512499
1-[3-[2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]propyl]pyrrolidin-2-one
CID 71872215
N-[[4-[(5-chloro-2-methoxyphenyl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71928027
N-[[4-(oxolan-3-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872272
N-[[(2S)-4-(1,2-oxazol-3-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512678
N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71928020

Frequently Asked Questions

What is the IUPAC name of N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The IUPAC name of N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine (CID 71928034) is N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine.
What is the SMILES notation for N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The canonical SMILES for N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine is Fc1ccccc1OCCN1CCOC(CNc2cccnn2)C1.
What is the InChIKey of N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The InChIKey is SWBYGJNQFUBIPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN4O2/c18-15-4-1-2-5-16(15)24-11-9-22-8-10-23-14(13-22)12-19-17-6-3-7-20-21-17/h1-7,14H,8-13H2,(H,19,21).
What are the key properties of N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine?
N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine has a molecular weight of 332.38 g/mol, XLogP of 1.81, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[2-(2-fluorophenoxy)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine is sourced from PubChem (CID 71928034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).