2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine

C16H18N2O — CID 137422541

IUPAC2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine
SMILESCCc1ccc(Oc2ccc(C3CC3N)cn2)cc1
InChIInChI=1S/C16H18N2O/c1-2-11-3-6-13(7-4-11)19-16-8-5-12(10-18-16)14-9-15(14)17/h3-8,10,14-15H,2,9,17H2,1H3
InChIKeyXGIRYTHUEINCDM-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.25
Rot. Bonds4

About 2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine

2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine (PubChem CID 137422541) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine.

Molecular Properties

Compound Name2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine
PubChem CID137422541
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine
SMILESCCc1ccc(Oc2ccc(C3CC3N)cn2)cc1
InChIInChI=1S/C16H18N2O/c1-2-11-3-6-13(7-4-11)19-16-8-5-12(10-18-16)14-9-15(14)17/h3-8,10,14-15H,2,9,17H2,1H3
InChIKeyXGIRYTHUEINCDM-UHFFFAOYSA-N
XLogP3.25
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(4-ethylphenoxy)pyridine-3-carbaldehyde
CID 80631614
N-[[6-(4-ethylphenoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62295710
6-(4-ethylphenoxy)pyridine-3-carboxamide
CID 91553748
5-(2-ethylcyclopropyl)-2-methoxypyridine
CID 59988749
2-ethyl-3-(4-ethylphenyl)cyclobutan-1-amine
CID 81415991
2-(4-butoxyphenyl)cyclopropan-1-amine
CID 59628060
CID 163843542
CID 163843542
ethyl 3-[[6-(4-ethylphenoxy)-3-pyridinyl]methylamino]propanoate
CID 118176696
ethyl 2-[2-(6-methoxy-3-pyridinyl)cyclopropyl]acetate
CID 59988842
6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine
CID 102449756
5-(chloromethyl)-2-(4-ethoxyphenoxy)pyridine
CID 61268972
ethyl 6-[4-(methylaminomethyl)phenoxy]pyridine-3-carboxylate
CID 106486678

Frequently Asked Questions

What is the IUPAC name of 2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine?
The IUPAC name of 2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine (CID 137422541) is 2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine.
What is the SMILES notation for 2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine?
The canonical SMILES for 2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine is CCc1ccc(Oc2ccc(C3CC3N)cn2)cc1.
What is the InChIKey of 2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine?
The InChIKey is XGIRYTHUEINCDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-2-11-3-6-13(7-4-11)19-16-8-5-12(10-18-16)14-9-15(14)17/h3-8,10,14-15H,2,9,17H2,1H3.
What are the key properties of 2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine?
2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine has a molecular weight of 254.33 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(4-ethylphenoxy)-3-pyridinyl]cyclopropan-1-amine is sourced from PubChem (CID 137422541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).