4-[1-(diethylamino)propan-2-yl]phenol

C13H21NO — CID 115025478

IUPAC4-[1-(diethylamino)propan-2-yl]phenol
SMILESCCN(CC)CC(C)c1ccc(O)cc1
InChIInChI=1S/C13H21NO/c1-4-14(5-2)10-11(3)12-6-8-13(15)9-7-12/h6-9,11,15H,4-5,10H2,1-3H3
InChIKeyPOPNNPIUCCAGAO-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.84
Rot. Bonds5

About 4-[1-(diethylamino)propan-2-yl]phenol

4-[1-(diethylamino)propan-2-yl]phenol (PubChem CID 115025478) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is 4-[1-(diethylamino)propan-2-yl]phenol.

Molecular Properties

Compound Name4-[1-(diethylamino)propan-2-yl]phenol
PubChem CID115025478
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name4-[1-(diethylamino)propan-2-yl]phenol
SMILESCCN(CC)CC(C)c1ccc(O)cc1
InChIInChI=1S/C13H21NO/c1-4-14(5-2)10-11(3)12-6-8-13(15)9-7-12/h6-9,11,15H,4-5,10H2,1-3H3
InChIKeyPOPNNPIUCCAGAO-UHFFFAOYSA-N
XLogP2.84
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[1-[ethyl(propyl)amino]propan-2-yl]aniline
CID 57120163
4-[[ethyl(methyl)amino]-hydroxymethyl]phenol
CID 67460714
4-hexan-2-ylphenol
CID 12579179
N-ethyl-2-phenyl-N-propylpropan-1-amine
CID 143014369
4-(1-ethoxypropan-2-yl)phenol
CID 91168138
4-[(4-butan-2-ylphenyl)methyl]phenol
CID 170030483
4-hept-4-yn-2-ylphenol
CID 83930417
4-[1-[bis(2-methylpropyl)amino]propyl]phenol
CID 82981957
(4R)-4-(4-hydroxyphenyl)pentan-2-one
CID 157310522
4-(4,6-dimethylheptan-2-yl)phenol
CID 6427088
4-[1-(4-hydroxyphenyl)ethyl]phenol
CID 608116
4-[6-(4-hydroxyphenyl)octan-2-yl]phenol
CID 23550616

Frequently Asked Questions

What is the IUPAC name of 4-[1-(diethylamino)propan-2-yl]phenol?
The IUPAC name of 4-[1-(diethylamino)propan-2-yl]phenol (CID 115025478) is 4-[1-(diethylamino)propan-2-yl]phenol.
What is the SMILES notation for 4-[1-(diethylamino)propan-2-yl]phenol?
The canonical SMILES for 4-[1-(diethylamino)propan-2-yl]phenol is CCN(CC)CC(C)c1ccc(O)cc1.
What is the InChIKey of 4-[1-(diethylamino)propan-2-yl]phenol?
The InChIKey is POPNNPIUCCAGAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-4-14(5-2)10-11(3)12-6-8-13(15)9-7-12/h6-9,11,15H,4-5,10H2,1-3H3.
What are the key properties of 4-[1-(diethylamino)propan-2-yl]phenol?
4-[1-(diethylamino)propan-2-yl]phenol has a molecular weight of 207.32 g/mol, XLogP of 2.84, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(diethylamino)propan-2-yl]phenol is sourced from PubChem (CID 115025478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).