(2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine

C10H15N — CID 44607335

IUPAC(2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine
SMILES[3H]c1cccc([3H])c1C[C@H](C)NC
InChIInChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m0/s1/i6T,7T
InChIKeyMYWUZJCMWCOHBA-CJTMEMAZSA-N
MW153.25 g/mol
LogP1.84
Rot. Bonds3

About (2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine

(2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine (PubChem CID 44607335) has the molecular formula C10H15N and a molecular weight of 153.25 g/mol. Its IUPAC name is (2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name(2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine
PubChem CID44607335
Molecular FormulaC10H15N
Molecular Weight153.25 g/mol
Exact Mass153.14
IUPAC Name(2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine
SMILES[3H]c1cccc([3H])c1C[C@H](C)NC
InChIInChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m0/s1/i6T,7T
InChIKeyMYWUZJCMWCOHBA-CJTMEMAZSA-N
XLogP1.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.25
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-1-phenylpropan-2-amine
CID 118309477
N-methyl-1-(4-phenylphenyl)propan-2-amine
CID 82540674
potassium;hydride;N-methyl-1-phenylpropan-2-amine
CID 175165101
(2S)-N-methyl-1-phenylpropan-2-amine;1,4-xylene
CID 174875624
azane;dichloromethane;(2S)-N-methyl-1-phenylpropan-2-amine;hydrate;hydrochloride
CID 173052639
(2S)-N-methyl-1-phenylpropan-2-amine;1-(1-phenylcyclohexyl)piperidine
CID 68763740
N-methyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]propan-2-amine
CID 82540074
2,6-diiodo-4-[2-(methylamino)propyl]phenol
CID 71359543
1-methyl-2-(1-phenylpropan-2-yl)hydrazine
CID 26556
1-fluoropropane;methanesulfinic acid;N-methyl-1-phenylpropan-2-amine
CID 143236357
N-methyl-1-[4-(2,2,2-trifluoroethyl)phenyl]propan-2-amine
CID 84726402
1-(4-cyclohexylphenyl)-N-methylpropan-2-amine
CID 82262296

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine?
The IUPAC name of (2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine (CID 44607335) is (2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine.
What is the SMILES notation for (2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine?
The canonical SMILES for (2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine is [3H]c1cccc([3H])c1C[C@H](C)NC.
What is the InChIKey of (2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine?
The InChIKey is MYWUZJCMWCOHBA-CJTMEMAZSA-N. The full InChI is InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m0/s1/i6T,7T.
What are the key properties of (2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine?
(2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine has a molecular weight of 153.25 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(2,6-ditritiophenyl)-N-methylpropan-2-amine is sourced from PubChem (CID 44607335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).