ethane;(1R)-1-phenylethanamine

C10H17N — CID 142977390

IUPACethane;(1R)-1-phenylethanamine
SMILESCC.C[C@@H](N)c1ccccc1
InChIInChI=1S/C8H11N.C2H6/c1-7(9)8-5-3-2-4-6-8;1-2/h2-7H,9H2,1H3;1-2H3/t7-;/m1./s1
InChIKeyWWCXBTYKXJXCSP-OGFXRTJISA-N
MW151.25 g/mol
LogP2.73
Rot. Bonds1

About ethane;(1R)-1-phenylethanamine

ethane;(1R)-1-phenylethanamine (PubChem CID 142977390) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is ethane;(1R)-1-phenylethanamine.

Molecular Properties

Compound Nameethane;(1R)-1-phenylethanamine
PubChem CID142977390
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Nameethane;(1R)-1-phenylethanamine
SMILESCC.C[C@@H](N)c1ccccc1
InChIInChI=1S/C8H11N.C2H6/c1-7(9)8-5-3-2-4-6-8;1-2/h2-7H,9H2,1H3;1-2H3/t7-;/m1./s1
InChIKeyWWCXBTYKXJXCSP-OGFXRTJISA-N
XLogP2.73
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of ethane;(1R)-1-phenylethanamine?
The IUPAC name of ethane;(1R)-1-phenylethanamine (CID 142977390) is ethane;(1R)-1-phenylethanamine.
What is the SMILES notation for ethane;(1R)-1-phenylethanamine?
The canonical SMILES for ethane;(1R)-1-phenylethanamine is CC.C[C@@H](N)c1ccccc1.
What is the InChIKey of ethane;(1R)-1-phenylethanamine?
The InChIKey is WWCXBTYKXJXCSP-OGFXRTJISA-N. The full InChI is InChI=1S/C8H11N.C2H6/c1-7(9)8-5-3-2-4-6-8;1-2/h2-7H,9H2,1H3;1-2H3/t7-;/m1./s1.
What are the key properties of ethane;(1R)-1-phenylethanamine?
ethane;(1R)-1-phenylethanamine has a molecular weight of 151.25 g/mol, XLogP of 2.73, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(1R)-1-phenylethanamine is sourced from PubChem (CID 142977390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).