N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride

C17H21ClN2O3 — CID 119709351

IUPACN-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride
SMILESCOc1ccc2ccccc2c1CNC(=O)C1COCCN1.Cl
InChIInChI=1S/C17H20N2O3.ClH/c1-21-16-7-6-12-4-2-3-5-13(12)14(16)10-19-17(20)15-11-22-9-8-18-15;/h2-7,15,18H,8-11H2,1H3,(H,19,20);1H
InChIKeyGWPWRNJAVQDJKY-UHFFFAOYSA-N
MW336.82 g/mol
LogP1.87
Rot. Bonds4

About N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride

N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride (PubChem CID 119709351) has the molecular formula C17H21ClN2O3 and a molecular weight of 336.82 g/mol. Its IUPAC name is N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride
PubChem CID119709351
Molecular FormulaC17H21ClN2O3
Molecular Weight336.82 g/mol
Exact Mass336.12
IUPAC NameN-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride
SMILESCOc1ccc2ccccc2c1CNC(=O)C1COCCN1.Cl
InChIInChI=1S/C17H20N2O3.ClH/c1-21-16-7-6-12-4-2-3-5-13(12)14(16)10-19-17(20)15-11-22-9-8-18-15;/h2-7,15,18H,8-11H2,1H3,(H,19,20);1H
InChIKeyGWPWRNJAVQDJKY-UHFFFAOYSA-N
XLogP1.87
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.82
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methoxynaphthalen-1-yl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119281586
N-[(3-chloro-4-methoxyphenyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119808070
N-[(2,3-dimethoxyphenyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119708865
N-[(3-methoxy-4-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119747493
N-[[4-(methoxymethyl)phenyl]methyl]morpholine-3-carboxamide;hydrochloride
CID 119718110
N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide
CID 119707515
N-[(2-methoxynaphthalen-1-yl)methyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119709381
N-(4-methoxy-2,3-dimethylphenyl)morpholine-3-carboxamide
CID 115177555
N-[(2-bromo-4,5-dimethoxyphenyl)methyl]morpholine-3-carboxamide
CID 119771820
N-[(3,4-dimethoxy-5-prop-2-enylphenyl)methyl]morpholine-3-carboxamide
CID 119763446
N-[2-(3,4-dimethoxyphenyl)-2-methylpropyl]morpholine-3-carboxamide;hydrochloride
CID 119777591
N-[(4-tert-butylphenyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119707397

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride (CID 119709351) is N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride is COc1ccc2ccccc2c1CNC(=O)C1COCCN1.Cl.
What is the InChIKey of N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride?
The InChIKey is GWPWRNJAVQDJKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3.ClH/c1-21-16-7-6-12-4-2-3-5-13(12)14(16)10-19-17(20)15-11-22-9-8-18-15;/h2-7,15,18H,8-11H2,1H3,(H,19,20);1H.
What are the key properties of N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride?
N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride has a molecular weight of 336.82 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119709351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).