(2R)-2-methyl-3-phenylpropan-1-imine

C10H13N — CID 59990579

IUPAC(2R)-2-methyl-3-phenylpropan-1-imine
SMILES[H]/N=C/[C@H](C)Cc1ccccc1
InChIInChI=1S/C10H13N/c1-9(8-11)7-10-5-3-2-4-6-10/h2-6,8-9,11H,7H2,1H3/b11-8+/t9-/m1/s1
InChIKeyIGIYMQQFQAFLDH-FJUNDMEASA-N
MW147.22 g/mol
LogP2.51
Rot. Bonds3

About (2R)-2-methyl-3-phenylpropan-1-imine

(2R)-2-methyl-3-phenylpropan-1-imine (PubChem CID 59990579) has the molecular formula C10H13N and a molecular weight of 147.22 g/mol. Its IUPAC name is (2R)-2-methyl-3-phenylpropan-1-imine.

Molecular Properties

Compound Name(2R)-2-methyl-3-phenylpropan-1-imine
PubChem CID59990579
Molecular FormulaC10H13N
Molecular Weight147.22 g/mol
Exact Mass147.10
IUPAC Name(2R)-2-methyl-3-phenylpropan-1-imine
SMILES[H]/N=C/[C@H](C)Cc1ccccc1
InChIInChI=1S/C10H13N/c1-9(8-11)7-10-5-3-2-4-6-10/h2-6,8-9,11H,7H2,1H3/b11-8+/t9-/m1/s1
InChIKeyIGIYMQQFQAFLDH-FJUNDMEASA-N
XLogP2.51
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-methyl-3-(2-methylphenyl)propan-1-imine
CID 123215278
[(E,2R)-5-bromo-2,4-dimethylpent-3-enyl]benzene
CID 11097089
2,4-dimethyl-5-phenylpent-2-enoic acid
CID 76793021
N-(2-methyl-3-phenylpropylidene)hydroxylamine
CID 88518263
(2S)-2-methyl-3-[4-(2-phenylethyl)phenyl]propanal
CID 167484075
benzyl(trimethyl)phosphanium;hydrobromide
CID 154945301
ethane;2-methylpropylbenzene
CID 162200929
benzyl(trimethyl)phosphanium;hydrochloride
CID 154945285
λ2-plumbane;1-phenylpropan-2-amine
CID 174896483
(2-benzyl-3-methylbutyl)benzene
CID 22277918
2,3-dimethylbutylbenzene
CID 12054035
(2S)-2-methyl-3-phenylpropanal;(2S)-2-methyl-3-phenylpropan-1-ol
CID 91547293

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-3-phenylpropan-1-imine?
The IUPAC name of (2R)-2-methyl-3-phenylpropan-1-imine (CID 59990579) is (2R)-2-methyl-3-phenylpropan-1-imine.
What is the SMILES notation for (2R)-2-methyl-3-phenylpropan-1-imine?
The canonical SMILES for (2R)-2-methyl-3-phenylpropan-1-imine is [H]/N=C/[C@H](C)Cc1ccccc1.
What is the InChIKey of (2R)-2-methyl-3-phenylpropan-1-imine?
The InChIKey is IGIYMQQFQAFLDH-FJUNDMEASA-N. The full InChI is InChI=1S/C10H13N/c1-9(8-11)7-10-5-3-2-4-6-10/h2-6,8-9,11H,7H2,1H3/b11-8+/t9-/m1/s1.
What are the key properties of (2R)-2-methyl-3-phenylpropan-1-imine?
(2R)-2-methyl-3-phenylpropan-1-imine has a molecular weight of 147.22 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-3-phenylpropan-1-imine is sourced from PubChem (CID 59990579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).