2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine

C20H23N3OS — CID 97068034

IUPAC2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine
SMILESCc1cc(NC[C@@H](c2cccs2)N2CCOCC2)c2ccccc2n1
InChIInChI=1S/C20H23N3OS/c1-15-13-18(16-5-2-3-6-17(16)22-15)21-14-19(20-7-4-12-25-20)23-8-10-24-11-9-23/h2-7,12-13,19H,8-11,14H2,1H3,(H,21,22)/t19-/m0/s1
InChIKeyRMPMKFCEOSREAL-IBGZPJMESA-N
MW353.49 g/mol
LogP4.09
Rot. Bonds5

About 2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine

2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine (PubChem CID 97068034) has the molecular formula C20H23N3OS and a molecular weight of 353.49 g/mol. Its IUPAC name is 2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine.

Molecular Properties

Compound Name2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine
PubChem CID97068034
Molecular FormulaC20H23N3OS
Molecular Weight353.49 g/mol
Exact Mass353.16
IUPAC Name2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine
SMILESCc1cc(NC[C@@H](c2cccs2)N2CCOCC2)c2ccccc2n1
InChIInChI=1S/C20H23N3OS/c1-15-13-18(16-5-2-3-6-17(16)22-15)21-14-19(20-7-4-12-25-20)23-8-10-24-11-9-23/h2-7,12-13,19H,8-11,14H2,1H3,(H,21,22)/t19-/m0/s1
InChIKeyRMPMKFCEOSREAL-IBGZPJMESA-N
XLogP4.09
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.49
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine with MolForge

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Related Compounds

N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(trifluoromethyl)quinolin-4-amine
CID 97083929
N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-methylquinolin-4-amine
CID 71899447
(1R)-N,N-dimethyl-N'-(2-methylquinolin-4-yl)-1-thiophen-2-ylethane-1,2-diamine
CID 97068033
4,6-dimethyl-2-[(2-morpholin-4-yl-2-thiophen-2-ylethyl)amino]pyridine-3-carboxamide
CID 17445790
6-methyl-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]imidazo[2,1-b][1,3,4]thiadiazol-2-amine
CID 94003063
N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyridin-3-ylquinazolin-4-amine
CID 31489441
N'-(2-methylquinolin-4-yl)-N-[(2S)-2-morpholin-4-yl-2-naphthalen-1-ylethyl]oxamide
CID 30835743
5-tert-butyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine
CID 127616527
N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide
CID 2395138
N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-(trifluoromethyl)quinolin-4-amine
CID 97083925
3,3-dimethyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)butan-1-amine
CID 119160582
2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine
CID 154842506

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine?
The IUPAC name of 2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine (CID 97068034) is 2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine.
What is the SMILES notation for 2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine?
The canonical SMILES for 2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine is Cc1cc(NC[C@@H](c2cccs2)N2CCOCC2)c2ccccc2n1.
What is the InChIKey of 2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine?
The InChIKey is RMPMKFCEOSREAL-IBGZPJMESA-N. The full InChI is InChI=1S/C20H23N3OS/c1-15-13-18(16-5-2-3-6-17(16)22-15)21-14-19(20-7-4-12-25-20)23-8-10-24-11-9-23/h2-7,12-13,19H,8-11,14H2,1H3,(H,21,22)/t19-/m0/s1.
What are the key properties of 2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine?
2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine has a molecular weight of 353.49 g/mol, XLogP of 4.09, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine is sourced from PubChem (CID 97068034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).