N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine

C14H17ClN4OS — CID 71928020

IUPACN-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
SMILESClc1ccc(CN2CCOC(CNc3cccnn3)C2)s1
InChIInChI=1S/C14H17ClN4OS/c15-13-4-3-12(21-13)10-19-6-7-20-11(9-19)8-16-14-2-1-5-17-18-14/h1-5,11H,6-10H2,(H,16,18)
InChIKeyPEQZFROKINFNPM-UHFFFAOYSA-N
MW324.84 g/mol
LogP2.50
Rot. Bonds5

About N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine

N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine (PubChem CID 71928020) has the molecular formula C14H17ClN4OS and a molecular weight of 324.84 g/mol. Its IUPAC name is N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
PubChem CID71928020
Molecular FormulaC14H17ClN4OS
Molecular Weight324.84 g/mol
Exact Mass324.08
IUPAC NameN-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
SMILESClc1ccc(CN2CCOC(CNc3cccnn3)C2)s1
InChIInChI=1S/C14H17ClN4OS/c15-13-4-3-12(21-13)10-19-6-7-20-11(9-19)8-16-14-2-1-5-17-18-14/h1-5,11H,6-10H2,(H,16,18)
InChIKeyPEQZFROKINFNPM-UHFFFAOYSA-N
XLogP2.50
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.84
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine with MolForge

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Related Compounds

N-[[(2S)-4-(1,2-oxazol-3-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512678
N-[[(2R)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512611
N-[[4-[(5-methyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872216
N-[[4-[(5-chloro-2-methoxyphenyl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71928027
N-[[(2R)-4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512573
N-[[(2R)-4-(2-thiophen-2-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 96512563
(2S)-2-[[(2R)-2-[(pyridazin-3-ylamino)methyl]morpholin-4-yl]methyl]pentanedinitrile
CID 98775216
N-[[4-[(2-propyl-1,3-thiazol-4-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872233
N-[[4-(2-methylsulfonylethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872271
N-[[4-(oxolan-3-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872272
2-(bromomethyl)-4-[(5-chlorothiophen-2-yl)methyl]morpholine
CID 81213537
N-[[4-[2-(cyclohexylamino)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 71872217

Frequently Asked Questions

What is the IUPAC name of N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The IUPAC name of N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine (CID 71928020) is N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine.
What is the SMILES notation for N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The canonical SMILES for N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine is Clc1ccc(CN2CCOC(CNc3cccnn3)C2)s1.
What is the InChIKey of N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The InChIKey is PEQZFROKINFNPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN4OS/c15-13-4-3-12(21-13)10-19-6-7-20-11(9-19)8-16-14-2-1-5-17-18-14/h1-5,11H,6-10H2,(H,16,18).
What are the key properties of N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine?
N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine has a molecular weight of 324.84 g/mol, XLogP of 2.50, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine is sourced from PubChem (CID 71928020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).