2-morpholin-3-yl-1-naphthalen-2-ylethanamine

C16H20N2O — CID 116941547

IUPAC2-morpholin-3-yl-1-naphthalen-2-ylethanamine
SMILESNC(CC1COCCN1)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O/c17-16(10-15-11-19-8-7-18-15)14-6-5-12-3-1-2-4-13(12)9-14/h1-6,9,15-16,18H,7-8,10-11,17H2
InChIKeyKINKEMZEDWKYNI-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.22
Rot. Bonds3

About 2-morpholin-3-yl-1-naphthalen-2-ylethanamine

2-morpholin-3-yl-1-naphthalen-2-ylethanamine (PubChem CID 116941547) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-morpholin-3-yl-1-naphthalen-2-ylethanamine.

Molecular Properties

Compound Name2-morpholin-3-yl-1-naphthalen-2-ylethanamine
PubChem CID116941547
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name2-morpholin-3-yl-1-naphthalen-2-ylethanamine
SMILESNC(CC1COCCN1)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O/c17-16(10-15-11-19-8-7-18-15)14-6-5-12-3-1-2-4-13(12)9-14/h1-6,9,15-16,18H,7-8,10-11,17H2
InChIKeyKINKEMZEDWKYNI-UHFFFAOYSA-N
XLogP2.22
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-3-yl-1-naphthalen-2-ylethanamine?
The IUPAC name of 2-morpholin-3-yl-1-naphthalen-2-ylethanamine (CID 116941547) is 2-morpholin-3-yl-1-naphthalen-2-ylethanamine.
What is the SMILES notation for 2-morpholin-3-yl-1-naphthalen-2-ylethanamine?
The canonical SMILES for 2-morpholin-3-yl-1-naphthalen-2-ylethanamine is NC(CC1COCCN1)c1ccc2ccccc2c1.
What is the InChIKey of 2-morpholin-3-yl-1-naphthalen-2-ylethanamine?
The InChIKey is KINKEMZEDWKYNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c17-16(10-15-11-19-8-7-18-15)14-6-5-12-3-1-2-4-13(12)9-14/h1-6,9,15-16,18H,7-8,10-11,17H2.
What are the key properties of 2-morpholin-3-yl-1-naphthalen-2-ylethanamine?
2-morpholin-3-yl-1-naphthalen-2-ylethanamine has a molecular weight of 256.35 g/mol, XLogP of 2.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-3-yl-1-naphthalen-2-ylethanamine is sourced from PubChem (CID 116941547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).