2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol

C16H28N2O — CID 64796324

IUPAC2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol
SMILESCCNC(C)(CO)CCCN(CC)c1ccccc1
InChIInChI=1S/C16H28N2O/c1-4-17-16(3,14-19)12-9-13-18(5-2)15-10-7-6-8-11-15/h6-8,10-11,17,19H,4-5,9,12-14H2,1-3H3
InChIKeyGNCLRMCABRLZEF-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.65
Rot. Bonds9

About 2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol

2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol (PubChem CID 64796324) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol.

Molecular Properties

Compound Name2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol
PubChem CID64796324
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol
SMILESCCNC(C)(CO)CCCN(CC)c1ccccc1
InChIInChI=1S/C16H28N2O/c1-4-17-16(3,14-19)12-9-13-18(5-2)15-10-7-6-8-11-15/h6-8,10-11,17,19H,4-5,9,12-14H2,1-3H3
InChIKeyGNCLRMCABRLZEF-UHFFFAOYSA-N
XLogP2.65
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 31235
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2-(4-Amino-N-ethylanilino)ethanol
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Ethanol, 2-(4-methylphenyl)amino-
CID 220008
m-Tolylethanolamine
CID 66886
(1R,2R)-2-(phenylamino)cyclopentan-1-ol
CID 11344319
Ethanol, 2-anilino-, hydrochloride
CID 218691
1-Diphenylamino-3-methylamino-propan-2-ol
CID 3159307
1-Anilinohexan-2-ol
CID 354829
1-(Phenylamino)propan-2-ol
CID 458691
8-Aniline-3,6-octadienol
CID 5473024
1-Anilino-3-(butylamino)propan-2-ol
CID 209570

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol?
The IUPAC name of 2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol (CID 64796324) is 2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol.
What is the SMILES notation for 2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol?
The canonical SMILES for 2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol is CCNC(C)(CO)CCCN(CC)c1ccccc1.
What is the InChIKey of 2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol?
The InChIKey is GNCLRMCABRLZEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-4-17-16(3,14-19)12-9-13-18(5-2)15-10-7-6-8-11-15/h6-8,10-11,17,19H,4-5,9,12-14H2,1-3H3.
What are the key properties of 2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol?
2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol has a molecular weight of 264.41 g/mol, XLogP of 2.65, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-5-(N-ethylanilino)-2-methylpentan-1-ol is sourced from PubChem (CID 64796324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).