azane;1-phenylpropan-2-amine

C9H16N2 — CID 67350534

IUPACazane;1-phenylpropan-2-amine
SMILESCC(N)Cc1ccccc1.N
InChIInChI=1S/C9H13N.H3N/c1-8(10)7-9-5-3-2-4-6-9;/h2-6,8H,7,10H2,1H3;1H3
InChIKeyCAZFOUKGIGNBSX-UHFFFAOYSA-N
MW152.24 g/mol
LogP1.74
Rot. Bonds2

About azane;1-phenylpropan-2-amine

azane;1-phenylpropan-2-amine (PubChem CID 67350534) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is azane;1-phenylpropan-2-amine.

Molecular Properties

Compound Nameazane;1-phenylpropan-2-amine
PubChem CID67350534
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Nameazane;1-phenylpropan-2-amine
SMILESCC(N)Cc1ccccc1.N
InChIInChI=1S/C9H13N.H3N/c1-8(10)7-9-5-3-2-4-6-9;/h2-6,8H,7,10H2,1H3;1H3
InChIKeyCAZFOUKGIGNBSX-UHFFFAOYSA-N
XLogP1.74
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

λ2-plumbane;1-phenylpropan-2-amine
CID 174896483
potassium;1-phenylpropan-2-amine;iodide
CID 70390373
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CID 160760295
λ2-plumbane;bis((2S)-1-phenylpropan-2-amine);sulfuric acid
CID 173242520
(2R)-1-phenylpropan-2-amine;phosphoric acid
CID 76961595
methanesulfonic acid;1-phenylpropan-2-amine
CID 173025540
tris(2-aminoacetic acid);1-phenylpropan-2-amine
CID 66730614
methanesulfonic acid;(2S)-1-phenylpropan-2-amine
CID 87182702
N-deuterio-1-phenylpropan-2-amine
CID 54017748
4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline
CID 170864530
(2S)-2-amino-3-hydroxypropanoic acid;1-phenylpropan-2-amine
CID 66730568
(2R)-3-methyl-1-phenylbutan-2-amine
CID 11390020

Frequently Asked Questions

What is the IUPAC name of azane;1-phenylpropan-2-amine?
The IUPAC name of azane;1-phenylpropan-2-amine (CID 67350534) is azane;1-phenylpropan-2-amine.
What is the SMILES notation for azane;1-phenylpropan-2-amine?
The canonical SMILES for azane;1-phenylpropan-2-amine is CC(N)Cc1ccccc1.N.
What is the InChIKey of azane;1-phenylpropan-2-amine?
The InChIKey is CAZFOUKGIGNBSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N.H3N/c1-8(10)7-9-5-3-2-4-6-9;/h2-6,8H,7,10H2,1H3;1H3.
What are the key properties of azane;1-phenylpropan-2-amine?
azane;1-phenylpropan-2-amine has a molecular weight of 152.24 g/mol, XLogP of 1.74, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1-phenylpropan-2-amine is sourced from PubChem (CID 67350534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).