N-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine

C18H18N2O — CID 62322003

IUPACN-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine
SMILESCCNCc1cccnc1Oc1cccc2ccccc12
InChIInChI=1S/C18H18N2O/c1-2-19-13-15-9-6-12-20-18(15)21-17-11-5-8-14-7-3-4-10-16(14)17/h3-12,19H,2,13H2,1H3
InChIKeyQVUDDFQQMSRAMU-UHFFFAOYSA-N
MW278.36 g/mol
LogP4.14
Rot. Bonds5

About N-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine

N-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine (PubChem CID 62322003) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is N-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine
PubChem CID62322003
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC NameN-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine
SMILESCCNCc1cccnc1Oc1cccc2ccccc12
InChIInChI=1S/C18H18N2O/c1-2-19-13-15-9-6-12-20-18(15)21-17-11-5-8-14-7-3-4-10-16(14)17/h3-12,19H,2,13H2,1H3
InChIKeyQVUDDFQQMSRAMU-UHFFFAOYSA-N
XLogP4.14
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-[2-(trifluoromethyl)phenoxy]-3-pyridinyl]methyl]ethanamine
CID 62296366
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
CID 61373670
N-(naphthalen-1-ylmethyl)ethanamine;hydrochloride
CID 17290740
N-methyl-1-(2-quinolin-8-yloxy-3-pyridinyl)methanamine
CID 62322209
N-[[2-(3,4-dimethylphenoxy)-3-pyridinyl]methyl]ethanamine
CID 62297843
[2-[2-(hydroxymethyl)phenoxy]-3-pyridinyl]methanol
CID 63653116
[2-(2-ethylphenoxy)-3-pyridinyl]methanol
CID 61257757
N-[(2-quinolin-8-ylphenyl)methyl]ethanamine
CID 81224519
N-[[2-(3,3-dimethylbutoxy)-3-pyridinyl]methyl]ethanamine
CID 66226371
N-[[2-(4-butan-2-ylphenoxy)-3-pyridinyl]methyl]ethanamine
CID 107668187
N-[(2-phenoxy-3-pyridinyl)methyl]propan-1-amine
CID 62295599
1-(2,3-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]methanamine
CID 60761596

Frequently Asked Questions

What is the IUPAC name of N-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine?
The IUPAC name of N-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine (CID 62322003) is N-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine.
What is the SMILES notation for N-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine?
The canonical SMILES for N-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine is CCNCc1cccnc1Oc1cccc2ccccc12.
What is the InChIKey of N-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine?
The InChIKey is QVUDDFQQMSRAMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-2-19-13-15-9-6-12-20-18(15)21-17-11-5-8-14-7-3-4-10-16(14)17/h3-12,19H,2,13H2,1H3.
What are the key properties of N-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine?
N-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine has a molecular weight of 278.36 g/mol, XLogP of 4.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-naphthalen-1-yloxy-3-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 62322003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).