(2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol

C14H23NO — CID 103906705

IUPAC(2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol
SMILESCCCc1ccc(C(C)NC[C@@H](C)O)cc1
InChIInChI=1S/C14H23NO/c1-4-5-13-6-8-14(9-7-13)12(3)15-10-11(2)16/h6-9,11-12,15-16H,4-5,10H2,1-3H3/t11-,12?/m1/s1
InChIKeyOMAFCWKGOPBMDS-JHJMLUEUSA-N
MW221.34 g/mol
LogP2.67
Rot. Bonds6

About (2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol

(2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol (PubChem CID 103906705) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is (2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol
PubChem CID103906705
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name(2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol
SMILESCCCc1ccc(C(C)NC[C@@H](C)O)cc1
InChIInChI=1S/C14H23NO/c1-4-5-13-6-8-14(9-7-13)12(3)15-10-11(2)16/h6-9,11-12,15-16H,4-5,10H2,1-3H3/t11-,12?/m1/s1
InChIKeyOMAFCWKGOPBMDS-JHJMLUEUSA-N
XLogP2.67
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[1-(4-butylphenyl)ethylamino]propan-2-ol
CID 43499262
N-[1-(4-propylphenyl)ethyl]propan-1-amine
CID 43185206
2-methyl-3-methylsulfanyl-N-[1-(4-propylphenyl)ethyl]propan-1-amine
CID 63983664
2-[1-(4-propylphenyl)ethylamino]-1-thiophen-3-ylethanol
CID 103785297
(2R)-1-[[(1S)-1-(4-fluorophenyl)ethyl]amino]propan-2-ol
CID 93033609
(2S)-1-[[(1S)-1-(4-bromophenyl)ethyl]amino]propan-2-ol
CID 93082226
N-[(4-ethylphenyl)methyl]-1-(4-propylphenyl)ethanamine
CID 106899436
2-[[(1S)-1-(4-propylphenyl)ethyl]amino]acetamide
CID 30045539
1-(4-propylanilino)propan-2-ol
CID 60884974
N-[1-(4-butylphenyl)ethyl]-2-methylbutan-1-amine
CID 63477867
2-[1-(4-butylphenyl)ethylamino]-1-cyclopropylethanol
CID 63294725
N-tert-butyl-2-[1-(4-propylphenyl)ethylamino]acetamide
CID 81298338

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol?
The IUPAC name of (2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol (CID 103906705) is (2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol.
What is the SMILES notation for (2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol?
The canonical SMILES for (2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol is CCCc1ccc(C(C)NC[C@@H](C)O)cc1.
What is the InChIKey of (2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol?
The InChIKey is OMAFCWKGOPBMDS-JHJMLUEUSA-N. The full InChI is InChI=1S/C14H23NO/c1-4-5-13-6-8-14(9-7-13)12(3)15-10-11(2)16/h6-9,11-12,15-16H,4-5,10H2,1-3H3/t11-,12?/m1/s1.
What are the key properties of (2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol?
(2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol has a molecular weight of 221.34 g/mol, XLogP of 2.67, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[1-(4-propylphenyl)ethylamino]propan-2-ol is sourced from PubChem (CID 103906705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).