2-butan-2-yloxy-N-ethyl-2-phenylethanamine

C14H23NO — CID 62108738

IUPAC2-butan-2-yloxy-N-ethyl-2-phenylethanamine
SMILESCCNCC(OC(C)CC)c1ccccc1
InChIInChI=1S/C14H23NO/c1-4-12(3)16-14(11-15-5-2)13-9-7-6-8-10-13/h6-10,12,14-15H,4-5,11H2,1-3H3
InChIKeyZGVALJWNSMSWSL-UHFFFAOYSA-N
MW221.34 g/mol
LogP3.15
Rot. Bonds7

About 2-butan-2-yloxy-N-ethyl-2-phenylethanamine

2-butan-2-yloxy-N-ethyl-2-phenylethanamine (PubChem CID 62108738) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 2-butan-2-yloxy-N-ethyl-2-phenylethanamine.

Molecular Properties

Compound Name2-butan-2-yloxy-N-ethyl-2-phenylethanamine
PubChem CID62108738
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name2-butan-2-yloxy-N-ethyl-2-phenylethanamine
SMILESCCNCC(OC(C)CC)c1ccccc1
InChIInChI=1S/C14H23NO/c1-4-12(3)16-14(11-15-5-2)13-9-7-6-8-10-13/h6-10,12,14-15H,4-5,11H2,1-3H3
InChIKeyZGVALJWNSMSWSL-UHFFFAOYSA-N
XLogP3.15
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-3-methyl-2-phenylpentan-1-amine
CID 43163708
N-(2-phenyl-2-propan-2-yloxyethyl)propan-1-amine
CID 62108020
N-[2-(3-bromophenyl)-2-butan-2-yloxyethyl]propan-1-amine
CID 55036561
(2R)-N-[(2R)-2-butan-2-yloxy-2-phenylethyl]-2-methoxy-N-[(2R)-2-methoxy-2-phenylethyl]-2-phenylethanamine
CID 146564671
2-(3-bromophenyl)-N-ethyl-2-propan-2-yloxyethanamine
CID 62108729
N-ethyl-2-(3-methylbut-3-enoxy)-2-phenylethanamine
CID 114470791
2-(2-cyclopropylethoxy)-N-ethyl-2-phenylethanamine
CID 106204975
2-butan-2-yloxy-2-(3-fluorophenyl)-N-methylethanamine
CID 62107675
(1S)-2-(ethylamino)-1-phenylethanol
CID 38989247
[butan-2-yloxy(ethoxy)methyl]benzene
CID 139725310
N-[2-butan-2-yloxy-2-(3-methoxyphenyl)ethyl]propan-2-amine
CID 62107144
2-(2,4-dichlorophenoxy)-N-ethyl-2-phenylethanamine
CID 62460096

Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yloxy-N-ethyl-2-phenylethanamine?
The IUPAC name of 2-butan-2-yloxy-N-ethyl-2-phenylethanamine (CID 62108738) is 2-butan-2-yloxy-N-ethyl-2-phenylethanamine.
What is the SMILES notation for 2-butan-2-yloxy-N-ethyl-2-phenylethanamine?
The canonical SMILES for 2-butan-2-yloxy-N-ethyl-2-phenylethanamine is CCNCC(OC(C)CC)c1ccccc1.
What is the InChIKey of 2-butan-2-yloxy-N-ethyl-2-phenylethanamine?
The InChIKey is ZGVALJWNSMSWSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-4-12(3)16-14(11-15-5-2)13-9-7-6-8-10-13/h6-10,12,14-15H,4-5,11H2,1-3H3.
What are the key properties of 2-butan-2-yloxy-N-ethyl-2-phenylethanamine?
2-butan-2-yloxy-N-ethyl-2-phenylethanamine has a molecular weight of 221.34 g/mol, XLogP of 3.15, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yloxy-N-ethyl-2-phenylethanamine is sourced from PubChem (CID 62108738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).