5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine

C16H20ClN3O — CID 116784042

IUPAC5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine
SMILESCCN1CCOC(CNc2ccc(Cl)c3cccnc23)C1
InChIInChI=1S/C16H20ClN3O/c1-2-20-8-9-21-12(11-20)10-19-15-6-5-14(17)13-4-3-7-18-16(13)15/h3-7,12,19H,2,8-11H2,1H3
InChIKeyFFOUJBUHLZDNBD-UHFFFAOYSA-N
MW305.81 g/mol
LogP3.02
Rot. Bonds4

About 5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine

5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine (PubChem CID 116784042) has the molecular formula C16H20ClN3O and a molecular weight of 305.81 g/mol. Its IUPAC name is 5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine.

Molecular Properties

Compound Name5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine
PubChem CID116784042
Molecular FormulaC16H20ClN3O
Molecular Weight305.81 g/mol
Exact Mass305.13
IUPAC Name5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine
SMILESCCN1CCOC(CNc2ccc(Cl)c3cccnc23)C1
InChIInChI=1S/C16H20ClN3O/c1-2-20-8-9-21-12(11-20)10-19-15-6-5-14(17)13-4-3-7-18-16(13)15/h3-7,12,19H,2,8-11H2,1H3
InChIKeyFFOUJBUHLZDNBD-UHFFFAOYSA-N
XLogP3.02
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.81
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-ethylmorpholin-2-yl)methyl]quinolin-4-amine
CID 115620947
2-chloro-N-[(4-ethylmorpholin-2-yl)methyl]-4-fluoroaniline
CID 79164853
4-chloro-N-[(4-ethylmorpholin-2-yl)methyl]-2,5-dimethoxyaniline
CID 79164835
2,4,6-trichloro-N-[(4-ethylmorpholin-2-yl)methyl]aniline
CID 79164415
2-[(4-ethylmorpholin-2-yl)methylamino]pyridine-3-carboxamide
CID 115619041
7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine
CID 116646580
N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine
CID 114400660
4-N-[(4-ethylmorpholin-2-yl)methyl]pyridine-3,4-diamine
CID 114399235
N-[(4-ethylmorpholin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
CID 102774345
N-[(4-ethylmorpholin-2-yl)methyl]-3-fluoro-2-methylaniline
CID 79166538
N-[(4-ethylmorpholin-2-yl)methyl]-1-methylimidazol-2-amine
CID 114400676
N-[[(2R)-4-ethylmorpholin-2-yl]methyl]quinoxalin-2-amine
CID 95319257

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine?
The IUPAC name of 5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine (CID 116784042) is 5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine.
What is the SMILES notation for 5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine?
The canonical SMILES for 5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine is CCN1CCOC(CNc2ccc(Cl)c3cccnc23)C1.
What is the InChIKey of 5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine?
The InChIKey is FFOUJBUHLZDNBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20ClN3O/c1-2-20-8-9-21-12(11-20)10-19-15-6-5-14(17)13-4-3-7-18-16(13)15/h3-7,12,19H,2,8-11H2,1H3.
What are the key properties of 5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine?
5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine has a molecular weight of 305.81 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine is sourced from PubChem (CID 116784042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).