N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride

C19H26ClN2O2- — CID 53350960

IUPACN-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride
SMILESCOc1ccc2ccccc2c1CNCCCN1CCOCC1.[Cl-]
InChIInChI=1S/C19H26N2O2.ClH/c1-22-19-8-7-16-5-2-3-6-17(16)18(19)15-20-9-4-10-21-11-13-23-14-12-21;/h2-3,5-8,20H,4,9-15H2,1H3;1H/p-1
InChIKeyWCGPAPQQVWNYTJ-UHFFFAOYSA-M
MW349.88 g/mol
LogP-0.34
Rot. Bonds7

About N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride

N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride (PubChem CID 53350960) has the molecular formula C19H26ClN2O2- and a molecular weight of 349.88 g/mol. Its IUPAC name is N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride.

Molecular Properties

Compound NameN-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride
PubChem CID53350960
Molecular FormulaC19H26ClN2O2-
Molecular Weight349.88 g/mol
Exact Mass349.17
IUPAC NameN-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride
SMILESCOc1ccc2ccccc2c1CNCCCN1CCOCC1.[Cl-]
InChIInChI=1S/C19H26N2O2.ClH/c1-22-19-8-7-16-5-2-3-6-17(16)18(19)15-20-9-4-10-21-11-13-23-14-12-21;/h2-3,5-8,20H,4,9-15H2,1H3;1H/p-1
InChIKeyWCGPAPQQVWNYTJ-UHFFFAOYSA-M
XLogP-0.34
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.88
LogP ≤ 5-0.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(2-ethoxynaphthalen-1-yl)methyl]-2-morpholin-4-ylethanamine;hydrochloride
CID 6603331
2-morpholin-4-yl-N-[(2-phenylmethoxynaphthalen-1-yl)methyl]ethanamine;dihydrochloride
CID 17294777
3-morpholin-4-yl-N-[(2,3,4-trimethoxyphenyl)methyl]propan-1-amine;dihydrochloride
CID 6457021
N-[(3-chloro-4-methoxyphenyl)methyl]-3-morpholin-4-ylpropan-1-amine
CID 29241559
N-[(2-methoxyphenyl)methyl]-3-morpholin-4-ylpropan-1-amine;oxalic acid
CID 17053127
4-[3-(2-ethoxynaphthalen-1-yl)propyl]morpholine
CID 170869209
N-[(5-chloro-2-methoxyphenyl)methyl]-3-morpholin-4-ylpropan-1-amine;dihydrochloride
CID 6457097
N-[(4-ethoxy-3-methoxyphenyl)methyl]-3-morpholin-4-ylpropan-1-amine
CID 3160557
3-[(2-methoxynaphthalen-1-yl)methylamino]propanenitrile
CID 43215614
3-morpholin-4-yl-N-(quinolin-4-ylmethyl)propan-1-amine
CID 63850211
N-[(3,5-dichloro-4-methoxyphenyl)methyl]-3-morpholin-4-ylpropan-1-amine
CID 29241589
3-[4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-1-yl]propan-1-amine
CID 54855934

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride?
The IUPAC name of N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride (CID 53350960) is N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride.
What is the SMILES notation for N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride?
The canonical SMILES for N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride is COc1ccc2ccccc2c1CNCCCN1CCOCC1.[Cl-].
What is the InChIKey of N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride?
The InChIKey is WCGPAPQQVWNYTJ-UHFFFAOYSA-M. The full InChI is InChI=1S/C19H26N2O2.ClH/c1-22-19-8-7-16-5-2-3-6-17(16)18(19)15-20-9-4-10-21-11-13-23-14-12-21;/h2-3,5-8,20H,4,9-15H2,1H3;1H/p-1.
What are the key properties of N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride?
N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride has a molecular weight of 349.88 g/mol, XLogP of -0.34, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride is sourced from PubChem (CID 53350960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).