azane;2-phenylethanamine

C8H14N2 — CID 23506485

IUPACazane;2-phenylethanamine
SMILESN.NCCc1ccccc1
InChIInChI=1S/C8H11N.H3N/c9-7-6-8-4-2-1-3-5-8;/h1-5H,6-7,9H2;1H3
InChIKeyJNDBWGDXMCXJPM-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.35
Rot. Bonds2

About azane;2-phenylethanamine

azane;2-phenylethanamine (PubChem CID 23506485) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is azane;2-phenylethanamine.

Molecular Properties

Compound Nameazane;2-phenylethanamine
PubChem CID23506485
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Nameazane;2-phenylethanamine
SMILESN.NCCc1ccccc1
InChIInChI=1S/C8H11N.H3N/c9-7-6-8-4-2-1-3-5-8;/h1-5H,6-7,9H2;1H3
InChIKeyJNDBWGDXMCXJPM-UHFFFAOYSA-N
XLogP1.35
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(2-phenylethyl)phenyl]ethanamine
CID 15036636
dichlorocopper;2-phenylethanamine;hydrochloride
CID 174793680
formic acid;2-phenylethanamine
CID 174535099
hydroxy(oxo)phosphanium;2-phenylethanamine
CID 173363711
perchloric acid;2-phenylethanamine
CID 71364418
N,N-diethylethanamine;2-phenylethanamine
CID 67440073
benzene;3-phenylpropan-1-amine
CID 174865683
2-[4-(2-aminoethyl)phenyl]ethanamine;hydrochloride
CID 68536204
2-[4-(2-aminoethyl)phenyl]ethanamine;hydroiodide
CID 175484243
benzene;2-phenylethylbenzene
CID 18982764
naphthalen-1-amine;2-phenylethanamine
CID 175144092
4-phenylbutan-1-amine;hydrochloride
CID 44630065

Frequently Asked Questions

What is the IUPAC name of azane;2-phenylethanamine?
The IUPAC name of azane;2-phenylethanamine (CID 23506485) is azane;2-phenylethanamine.
What is the SMILES notation for azane;2-phenylethanamine?
The canonical SMILES for azane;2-phenylethanamine is N.NCCc1ccccc1.
What is the InChIKey of azane;2-phenylethanamine?
The InChIKey is JNDBWGDXMCXJPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N.H3N/c9-7-6-8-4-2-1-3-5-8;/h1-5H,6-7,9H2;1H3.
What are the key properties of azane;2-phenylethanamine?
azane;2-phenylethanamine has a molecular weight of 138.21 g/mol, XLogP of 1.35, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;2-phenylethanamine is sourced from PubChem (CID 23506485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).