N-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine

C16H21N3O — CID 83099652

IUPACN-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine
SMILESCNCC1COCCN1Cc1cccc2cccnc12
InChIInChI=1S/C16H21N3O/c1-17-10-15-12-20-9-8-19(15)11-14-5-2-4-13-6-3-7-18-16(13)14/h2-7,15,17H,8-12H2,1H3
InChIKeyBTCGJGPVAUEXFR-UHFFFAOYSA-N
MW271.36 g/mol
LogP1.65
Rot. Bonds4

About N-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine

N-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine (PubChem CID 83099652) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is N-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine
PubChem CID83099652
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC NameN-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine
SMILESCNCC1COCCN1Cc1cccc2cccnc12
InChIInChI=1S/C16H21N3O/c1-17-10-15-12-20-9-8-19(15)11-14-5-2-4-13-6-3-7-18-16(13)14/h2-7,15,17H,8-12H2,1H3
InChIKeyBTCGJGPVAUEXFR-UHFFFAOYSA-N
XLogP1.65
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine?
The IUPAC name of N-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine (CID 83099652) is N-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine.
What is the SMILES notation for N-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine?
The canonical SMILES for N-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine is CNCC1COCCN1Cc1cccc2cccnc12.
What is the InChIKey of N-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine?
The InChIKey is BTCGJGPVAUEXFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-17-10-15-12-20-9-8-19(15)11-14-5-2-4-13-6-3-7-18-16(13)14/h2-7,15,17H,8-12H2,1H3.
What are the key properties of N-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine?
N-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine has a molecular weight of 271.36 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[4-(quinolin-8-ylmethyl)morpholin-3-yl]methanamine is sourced from PubChem (CID 83099652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).