(2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine

C17H16ClN3O2S — CID 176863568

IUPAC(2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine
SMILESClc1cc(-c2cc3ncccc3c(OC[C@@H]3CNCCO3)n2)cs1
InChIInChI=1S/C17H16ClN3O2S/c18-16-6-11(10-24-16)14-7-15-13(2-1-3-20-15)17(21-14)23-9-12-8-19-4-5-22-12/h1-3,6-7,10,12,19H,4-5,8-9H2/t12-/m0/s1
InChIKeyNSUJMDGVRQONIA-LBPRGKRZSA-N
MW361.85 g/mol
LogP3.38
Rot. Bonds4

About (2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine

(2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine (PubChem CID 176863568) has the molecular formula C17H16ClN3O2S and a molecular weight of 361.85 g/mol. Its IUPAC name is (2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine.

Molecular Properties

Compound Name(2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine
PubChem CID176863568
Molecular FormulaC17H16ClN3O2S
Molecular Weight361.85 g/mol
Exact Mass361.07
IUPAC Name(2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine
SMILESClc1cc(-c2cc3ncccc3c(OC[C@@H]3CNCCO3)n2)cs1
InChIInChI=1S/C17H16ClN3O2S/c18-16-6-11(10-24-16)14-7-15-13(2-1-3-20-15)17(21-14)23-9-12-8-19-4-5-22-12/h1-3,6-7,10,12,19H,4-5,8-9H2/t12-/m0/s1
InChIKeyNSUJMDGVRQONIA-LBPRGKRZSA-N
XLogP3.38
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.85
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

US10941138, Example 41
CID 135145281
US10941138, Example 78
CID 135145285
N-[(7-methoxy-2-thiophen-3-ylquinolin-3-yl)methyl]-2-quinolin-5-yloxyethanamine
CID 59804021
2-{4-[5-Methoxy-3-(2-thienyl)-1,6-naphthyridin-2-yl]phenyl}propan-2-amine
CID 69059274
N-(2-chloro-5-methoxyphenyl)-7-[5-(morpholin-4-ylmethyl)thiophen-3-yl]quinolin-4-amine
CID 70014889
(3S)-3-(5-chlorothiophen-2-yl)-N-methyl-3-quinolin-5-yloxypropan-1-amine
CID 135145280
3-Bromo-7-chloro-5-(4-thiophen-2-ylcyclohexyl)oxy-1,6-naphthyridine
CID 156166993
(3S)-3-(5-chlorothiophen-2-yl)-N-methyl-3-quinolin-5-yloxypropan-1-amine;(3R)-3-(5-chlorothiophen-2-yl)-N-methyl-3-quinolin-5-yloxypropan-1-amine
CID 159013527
1-[6-Chloro-1-(4-ethylsulfanylbutan-2-yloxy)-2,7-naphthyridin-4-yl]propan-1-amine
CID 166483963
(2S)-2-[(1R)-1-[[7-(1-methylpyrrol-3-yl)-1,6-naphthyridin-5-yl]oxy]ethyl]morpholine
CID 175950102
(2S)-2-[[7-(1-propan-2-ylpyrrol-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine
CID 175950103
(6S)-6-[[7-(1-ethylpyrrol-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]-2,2-dimethylmorpholine
CID 175950119

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine?
The IUPAC name of (2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine (CID 176863568) is (2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine.
What is the SMILES notation for (2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine?
The canonical SMILES for (2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine is Clc1cc(-c2cc3ncccc3c(OC[C@@H]3CNCCO3)n2)cs1.
What is the InChIKey of (2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine?
The InChIKey is NSUJMDGVRQONIA-LBPRGKRZSA-N. The full InChI is InChI=1S/C17H16ClN3O2S/c18-16-6-11(10-24-16)14-7-15-13(2-1-3-20-15)17(21-14)23-9-12-8-19-4-5-22-12/h1-3,6-7,10,12,19H,4-5,8-9H2/t12-/m0/s1.
What are the key properties of (2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine?
(2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine has a molecular weight of 361.85 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[[7-(5-chlorothiophen-3-yl)-1,6-naphthyridin-5-yl]oxymethyl]morpholine is sourced from PubChem (CID 176863568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).