2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine

C15H23N — CID 83154874

IUPAC2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine
SMILESCc1cc(C)c(C(N)C(C)C2CC2)c(C)c1
InChIInChI=1S/C15H23N/c1-9-7-10(2)14(11(3)8-9)15(16)12(4)13-5-6-13/h7-8,12-13,15H,5-6,16H2,1-4H3
InChIKeyMEKCNFLWYNGVLJ-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.66
Rot. Bonds3

About 2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine

2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine (PubChem CID 83154874) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine
PubChem CID83154874
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine
SMILESCc1cc(C)c(C(N)C(C)C2CC2)c(C)c1
InChIInChI=1S/C15H23N/c1-9-7-10(2)14(11(3)8-9)15(16)12(4)13-5-6-13/h7-8,12-13,15H,5-6,16H2,1-4H3
InChIKeyMEKCNFLWYNGVLJ-UHFFFAOYSA-N
XLogP3.66
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R,2S)-2-amino-1-cyclopentyl-2-(2,4,6-trimethylphenyl)ethanol
CID 171268340
(1S,2S)-1,2-bis(2,4,6-trimethylphenyl)ethane-1,2-diamine
CID 11289465
2-cyclopropyl-1-(2,5-dimethylphenyl)propan-1-amine
CID 83154374
(R)-cyclohexyl-(2,4,6-trimethylphenyl)methanamine
CID 92649968
cycloheptyl-(2,4,6-trimethylphenyl)methanamine
CID 63522004
2-cyclopropyl-1-(2,4,5-trimethylphenyl)propan-1-amine
CID 104990610
2-[(R)-amino(cyclopropyl)methyl]-3,5-dimethylphenol
CID 130674108
1-(2-chloro-4,5-dimethylphenyl)-2-cyclopropylpropan-1-amine
CID 83154402
(3,4-dimethylcyclohexyl)-(2,4,6-trimethylphenyl)methanamine
CID 104989384
4-[amino-(2,4,6-trimethylphenyl)methyl]-N-methylcyclohexan-1-amine
CID 116937242
2-cyclopropyl-1-(2,4,6-trimethoxyphenyl)propan-1-amine
CID 83154373
(4-tert-butylcyclohexyl)-(2,4,6-trimethylphenyl)methanamine
CID 63522356

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine?
The IUPAC name of 2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine (CID 83154874) is 2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine.
What is the SMILES notation for 2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine?
The canonical SMILES for 2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine is Cc1cc(C)c(C(N)C(C)C2CC2)c(C)c1.
What is the InChIKey of 2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine?
The InChIKey is MEKCNFLWYNGVLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-9-7-10(2)14(11(3)8-9)15(16)12(4)13-5-6-13/h7-8,12-13,15H,5-6,16H2,1-4H3.
What are the key properties of 2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine?
2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(2,4,6-trimethylphenyl)propan-1-amine is sourced from PubChem (CID 83154874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).