(1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride

C20H25ClN2O3 — CID 154924796

IUPAC(1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride
SMILESCOc1ccc2cc(C3CN(C(=O)C4(N)CCC4)CCO3)ccc2c1.Cl
InChIInChI=1S/C20H24N2O3.ClH/c1-24-17-6-5-14-11-16(4-3-15(14)12-17)18-13-22(9-10-25-18)19(23)20(21)7-2-8-20;/h3-6,11-12,18H,2,7-10,13,21H2,1H3;1H
InChIKeyPUCAQDAVMAWAPK-UHFFFAOYSA-N
MW376.88 g/mol
LogP3.05
Rot. Bonds3

About (1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride

(1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride (PubChem CID 154924796) has the molecular formula C20H25ClN2O3 and a molecular weight of 376.88 g/mol. Its IUPAC name is (1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride.

Molecular Properties

Compound Name(1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride
PubChem CID154924796
Molecular FormulaC20H25ClN2O3
Molecular Weight376.88 g/mol
Exact Mass376.16
IUPAC Name(1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride
SMILESCOc1ccc2cc(C3CN(C(=O)C4(N)CCC4)CCO3)ccc2c1.Cl
InChIInChI=1S/C20H24N2O3.ClH/c1-24-17-6-5-14-11-16(4-3-15(14)12-17)18-13-22(9-10-25-18)19(23)20(21)7-2-8-20;/h3-6,11-12,18H,2,7-10,13,21H2,1H3;1H
InChIKeyPUCAQDAVMAWAPK-UHFFFAOYSA-N
XLogP3.05
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.88
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-1-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]propan-1-one;hydrochloride
CID 154892310
2-(4-hydroxyphenyl)-1-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]ethanone
CID 95545231
1-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]-3-pyrrolidin-1-ylpropan-1-one
CID 95556663
1-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]-3-pyrrolidin-1-ylpropan-1-one
CID 95556664
1-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]butane-1,2-dione
CID 95562775
1-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]butane-1,2-dione
CID 95562776
2-(diethylamino)-1-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]ethanone
CID 95455738
methyl N-[2-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]-2-oxoethyl]carbamate
CID 95463844
[3-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]-3-oxopropyl]urea
CID 95525209
1-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]-2-piperazin-1-ylethanone;hydrochloride
CID 154892435
[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]-(oxan-4-yl)methanone
CID 56866342
(4-hydroxy-3-methoxyphenyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone
CID 95550019

Frequently Asked Questions

What is the IUPAC name of (1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride?
The IUPAC name of (1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride (CID 154924796) is (1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride.
What is the SMILES notation for (1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride?
The canonical SMILES for (1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride is COc1ccc2cc(C3CN(C(=O)C4(N)CCC4)CCO3)ccc2c1.Cl.
What is the InChIKey of (1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride?
The InChIKey is PUCAQDAVMAWAPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3.ClH/c1-24-17-6-5-14-11-16(4-3-15(14)12-17)18-13-22(9-10-25-18)19(23)20(21)7-2-8-20;/h3-6,11-12,18H,2,7-10,13,21H2,1H3;1H.
What are the key properties of (1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride?
(1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride has a molecular weight of 376.88 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride is sourced from PubChem (CID 154924796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).