N-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine

C18H24N2O — CID 115495045

IUPACN-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine
SMILESCCNC(C)Cc1ccc(OCCc2ccccn2)cc1
InChIInChI=1S/C18H24N2O/c1-3-19-15(2)14-16-7-9-18(10-8-16)21-13-11-17-6-4-5-12-20-17/h4-10,12,15,19H,3,11,13-14H2,1-2H3
InChIKeyZRJXYAWHGSMQIL-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.24
Rot. Bonds8

About N-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine

N-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine (PubChem CID 115495045) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine
PubChem CID115495045
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine
SMILESCCNC(C)Cc1ccc(OCCc2ccccn2)cc1
InChIInChI=1S/C18H24N2O/c1-3-19-15(2)14-16-7-9-18(10-8-16)21-13-11-17-6-4-5-12-20-17/h4-10,12,15,19H,3,11,13-14H2,1-2H3
InChIKeyZRJXYAWHGSMQIL-UHFFFAOYSA-N
XLogP3.24
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-[4-(3-methylbutoxy)phenyl]propan-2-amine
CID 115494877
N-ethyl-1-[4-(2-propoxyethoxy)phenyl]propan-2-amine
CID 106450535
1-(4-bromophenyl)-N-(2-pyridin-2-ylethyl)propan-2-amine
CID 103522112
N-ethyl-1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-amine
CID 115981835
(1R)-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-1-amine
CID 78937530
N-ethyl-1-(4-prop-2-enoxyphenyl)propan-2-amine
CID 115494903
4-(2-pyridin-2-ylethoxy)phenol
CID 60892821
N-ethyl-4-methyl-1-pyridin-2-ylpentan-3-amine
CID 105078244
N-ethyl-1-(4-prop-2-ynoxyphenyl)propan-2-amine
CID 115495069
1-[5-(2-pyridin-2-ylethoxy)-2-pyridinyl]propan-2-amine
CID 79799428
N-[(4-propoxyphenyl)methyl]-2-pyridin-2-ylethanamine
CID 28614976
N-ethyl-1-[4-(2-propylsulfonylethoxy)phenyl]propan-2-amine
CID 106722425

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine?
The IUPAC name of N-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine (CID 115495045) is N-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine.
What is the SMILES notation for N-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine?
The canonical SMILES for N-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine is CCNC(C)Cc1ccc(OCCc2ccccn2)cc1.
What is the InChIKey of N-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine?
The InChIKey is ZRJXYAWHGSMQIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-3-19-15(2)14-16-7-9-18(10-8-16)21-13-11-17-6-4-5-12-20-17/h4-10,12,15,19H,3,11,13-14H2,1-2H3.
What are the key properties of N-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine?
N-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine has a molecular weight of 284.40 g/mol, XLogP of 3.24, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-2-amine is sourced from PubChem (CID 115495045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).