3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine

C22H31N3O2 — CID 97340056

IUPAC3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine
SMILESCCc1c(C)nc2ccccc2c1NC[C@@H]([C@H]1CCOC1)N1CCOCC1
InChIInChI=1S/C22H31N3O2/c1-3-18-16(2)24-20-7-5-4-6-19(20)22(18)23-14-21(17-8-11-27-15-17)25-9-12-26-13-10-25/h4-7,17,21H,3,8-15H2,1-2H3,(H,23,24)/t17-,21-/m0/s1
InChIKeyCTUXOIVAZYWRGS-UWJYYQICSA-N
MW369.51 g/mol
LogP3.25
Rot. Bonds6

About 3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine

3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine (PubChem CID 97340056) has the molecular formula C22H31N3O2 and a molecular weight of 369.51 g/mol. Its IUPAC name is 3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine.

Molecular Properties

Compound Name3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine
PubChem CID97340056
Molecular FormulaC22H31N3O2
Molecular Weight369.51 g/mol
Exact Mass369.24
IUPAC Name3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine
SMILESCCc1c(C)nc2ccccc2c1NC[C@@H]([C@H]1CCOC1)N1CCOCC1
InChIInChI=1S/C22H31N3O2/c1-3-18-16(2)24-20-7-5-4-6-19(20)22(18)23-14-21(17-8-11-27-15-17)25-9-12-26-13-10-25/h4-7,17,21H,3,8-15H2,1-2H3,(H,23,24)/t17-,21-/m0/s1
InChIKeyCTUXOIVAZYWRGS-UWJYYQICSA-N
XLogP3.25
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.51
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine with MolForge

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Launch Full Analysis

Related Compounds

3-ethyl-2-methyl-N-(oxolan-3-yl)quinolin-4-amine
CID 133438561
N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine
CID 42943739
(2S)-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-2-phenylbutanamide
CID 94150246
3-methyl-1-[[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]amino]pyrido[1,2-a]benzimidazole-4-carbonitrile
CID 31658168
N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide
CID 94083483
N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-amine
CID 25330357
N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-1,6-naphthyridin-4-amine
CID 95973156
(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine
CID 124738760
2-morpholin-4-yl-2-(oxolan-3-yl)-N-[phenyl(pyridin-2-yl)methyl]ethanamine
CID 75449073
N-[[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]methyl]-2-morpholin-4-yl-2-(oxolan-3-yl)ethanamine
CID 47030614
2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-amine
CID 31657857
3-ethyl-N,2-dimethyl-N-(oxan-4-ylmethyl)quinolin-4-amine
CID 133438764

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine?
The IUPAC name of 3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine (CID 97340056) is 3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine.
What is the SMILES notation for 3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine?
The canonical SMILES for 3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine is CCc1c(C)nc2ccccc2c1NC[C@@H]([C@H]1CCOC1)N1CCOCC1.
What is the InChIKey of 3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine?
The InChIKey is CTUXOIVAZYWRGS-UWJYYQICSA-N. The full InChI is InChI=1S/C22H31N3O2/c1-3-18-16(2)24-20-7-5-4-6-19(20)22(18)23-14-21(17-8-11-27-15-17)25-9-12-26-13-10-25/h4-7,17,21H,3,8-15H2,1-2H3,(H,23,24)/t17-,21-/m0/s1.
What are the key properties of 3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine?
3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine has a molecular weight of 369.51 g/mol, XLogP of 3.25, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine is sourced from PubChem (CID 97340056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).