2-(nonan-2-ylamino)-1-phenylethanol

C17H29NO — CID 43499169

IUPAC2-(nonan-2-ylamino)-1-phenylethanol
SMILESCCCCCCCC(C)NCC(O)c1ccccc1
InChIInChI=1S/C17H29NO/c1-3-4-5-6-8-11-15(2)18-14-17(19)16-12-9-7-10-13-16/h7,9-10,12-13,15,17-19H,3-6,8,11,14H2,1-2H3
InChIKeyMPIZEDVJKCCPTN-UHFFFAOYSA-N
MW263.43 g/mol
LogP4.06
Rot. Bonds10

About 2-(nonan-2-ylamino)-1-phenylethanol

2-(nonan-2-ylamino)-1-phenylethanol (PubChem CID 43499169) has the molecular formula C17H29NO and a molecular weight of 263.43 g/mol. Its IUPAC name is 2-(nonan-2-ylamino)-1-phenylethanol.

Molecular Properties

Compound Name2-(nonan-2-ylamino)-1-phenylethanol
PubChem CID43499169
Molecular FormulaC17H29NO
Molecular Weight263.43 g/mol
Exact Mass263.22
IUPAC Name2-(nonan-2-ylamino)-1-phenylethanol
SMILESCCCCCCCC(C)NCC(O)c1ccccc1
InChIInChI=1S/C17H29NO/c1-3-4-5-6-8-11-15(2)18-14-17(19)16-12-9-7-10-13-16/h7,9-10,12-13,15,17-19H,3-6,8,11,14H2,1-2H3
InChIKeyMPIZEDVJKCCPTN-UHFFFAOYSA-N
XLogP4.06
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(octan-2-ylamino)-1-(4-propan-2-ylphenyl)ethanol
CID 63491374
N-(2-phenylpropyl)nonan-2-amine
CID 43130018
1-(3-bromophenyl)-2-(heptan-2-ylamino)ethanol
CID 60734300
(1R)-1-phenyloctan-1-ol
CID 12794259
2-(heptan-2-ylamino)-1-[3-(trifluoromethyl)phenyl]ethanol
CID 60980974
1-(3,4-difluorophenyl)-2-(heptan-2-ylamino)ethanol
CID 60980975
1-(3-bromophenyl)-2-(hexan-2-ylamino)ethanol
CID 55050060
2-[(2-hydroxy-2-phenylethyl)amino]propan-1-ol
CID 60886442
(1S)-2-(hexylamino)-1-phenylethanol
CID 102581936
2-(hexan-2-ylamino)-1-(4-methylsulfonylphenyl)ethanol
CID 62200407
dihydroxy(oxo)phosphanium;1-phenylundecan-1-ol
CID 69241764
(1S)-1-phenylpentan-1-ol
CID 6992754

Frequently Asked Questions

What is the IUPAC name of 2-(nonan-2-ylamino)-1-phenylethanol?
The IUPAC name of 2-(nonan-2-ylamino)-1-phenylethanol (CID 43499169) is 2-(nonan-2-ylamino)-1-phenylethanol.
What is the SMILES notation for 2-(nonan-2-ylamino)-1-phenylethanol?
The canonical SMILES for 2-(nonan-2-ylamino)-1-phenylethanol is CCCCCCCC(C)NCC(O)c1ccccc1.
What is the InChIKey of 2-(nonan-2-ylamino)-1-phenylethanol?
The InChIKey is MPIZEDVJKCCPTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NO/c1-3-4-5-6-8-11-15(2)18-14-17(19)16-12-9-7-10-13-16/h7,9-10,12-13,15,17-19H,3-6,8,11,14H2,1-2H3.
What are the key properties of 2-(nonan-2-ylamino)-1-phenylethanol?
2-(nonan-2-ylamino)-1-phenylethanol has a molecular weight of 263.43 g/mol, XLogP of 4.06, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(nonan-2-ylamino)-1-phenylethanol is sourced from PubChem (CID 43499169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).