3-(morpholin-4-ylmethyl)naphthalen-2-amine

C15H18N2O — CID 61214111

IUPAC3-(morpholin-4-ylmethyl)naphthalen-2-amine
SMILESNc1cc2ccccc2cc1CN1CCOCC1
InChIInChI=1S/C15H18N2O/c16-15-10-13-4-2-1-3-12(13)9-14(15)11-17-5-7-18-8-6-17/h1-4,9-10H,5-8,11,16H2
InChIKeyPQAVOFZSCJWEFW-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.25
Rot. Bonds2

About 3-(morpholin-4-ylmethyl)naphthalen-2-amine

3-(morpholin-4-ylmethyl)naphthalen-2-amine (PubChem CID 61214111) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 3-(morpholin-4-ylmethyl)naphthalen-2-amine.

Molecular Properties

Compound Name3-(morpholin-4-ylmethyl)naphthalen-2-amine
PubChem CID61214111
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name3-(morpholin-4-ylmethyl)naphthalen-2-amine
SMILESNc1cc2ccccc2cc1CN1CCOCC1
InChIInChI=1S/C15H18N2O/c16-15-10-13-4-2-1-3-12(13)9-14(15)11-17-5-7-18-8-6-17/h1-4,9-10H,5-8,11,16H2
InChIKeyPQAVOFZSCJWEFW-UHFFFAOYSA-N
XLogP2.25
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[(3,3-dimethylmorpholin-4-yl)methyl]naphthalen-2-amine
CID 61430608
4-[3-[3-(3-morpholin-4-ylpropyl)naphthalen-2-yl]propyl]morpholine
CID 170869299
3-[(5-methyl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalen-2-amine
CID 106315092
5-amino-2-(morpholin-4-ylmethyl)phenol
CID 19799808
5-chloro-2-(1,4-oxazepan-4-ylmethyl)aniline
CID 62986873
5-bromo-2-(1,4-oxazepan-4-ylmethyl)aniline
CID 79712420
4-[[2-(1,3-dihydroisoindol-2-ylmethyl)phenyl]methyl]morpholine
CID 13041711
10-(anthracen-9-ylmethyl)-1,4,7-trioxa-10-azacyclododecane
CID 101025185
ethane;4-[(2-methylphenyl)methyl]morpholine
CID 142083627
3-methyl-4-(morpholin-4-ylmethyl)benzene-1,2-diamine
CID 23441207
4-[(7-bromo-3-methylnaphthalen-2-yl)methyl]morpholine
CID 139210695
trifluoro-[2-(morpholin-4-ylmethyl)phenyl]boranuide
CID 53488026

Frequently Asked Questions

What is the IUPAC name of 3-(morpholin-4-ylmethyl)naphthalen-2-amine?
The IUPAC name of 3-(morpholin-4-ylmethyl)naphthalen-2-amine (CID 61214111) is 3-(morpholin-4-ylmethyl)naphthalen-2-amine.
What is the SMILES notation for 3-(morpholin-4-ylmethyl)naphthalen-2-amine?
The canonical SMILES for 3-(morpholin-4-ylmethyl)naphthalen-2-amine is Nc1cc2ccccc2cc1CN1CCOCC1.
What is the InChIKey of 3-(morpholin-4-ylmethyl)naphthalen-2-amine?
The InChIKey is PQAVOFZSCJWEFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c16-15-10-13-4-2-1-3-12(13)9-14(15)11-17-5-7-18-8-6-17/h1-4,9-10H,5-8,11,16H2.
What are the key properties of 3-(morpholin-4-ylmethyl)naphthalen-2-amine?
3-(morpholin-4-ylmethyl)naphthalen-2-amine has a molecular weight of 242.32 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(morpholin-4-ylmethyl)naphthalen-2-amine is sourced from PubChem (CID 61214111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).