5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine

C13H23N3O — CID 62283072

IUPAC5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine
SMILESCCNCc1ccc(N(C)C(C)COC)nc1
InChIInChI=1S/C13H23N3O/c1-5-14-8-12-6-7-13(15-9-12)16(3)11(2)10-17-4/h6-7,9,11,14H,5,8,10H2,1-4H3
InChIKeyYWLUBLYUZXJDSS-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.66
Rot. Bonds7

About 5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine

5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine (PubChem CID 62283072) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine.

Molecular Properties

Compound Name5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine
PubChem CID62283072
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine
SMILESCCNCc1ccc(N(C)C(C)COC)nc1
InChIInChI=1S/C13H23N3O/c1-5-14-8-12-6-7-13(15-9-12)16(3)11(2)10-17-4/h6-7,9,11,14H,5,8,10H2,1-4H3
InChIKeyYWLUBLYUZXJDSS-UHFFFAOYSA-N
XLogP1.66
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine?
The IUPAC name of 5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine (CID 62283072) is 5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine.
What is the SMILES notation for 5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine?
The canonical SMILES for 5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine is CCNCc1ccc(N(C)C(C)COC)nc1.
What is the InChIKey of 5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine?
The InChIKey is YWLUBLYUZXJDSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-5-14-8-12-6-7-13(15-9-12)16(3)11(2)10-17-4/h6-7,9,11,14H,5,8,10H2,1-4H3.
What are the key properties of 5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine?
5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine has a molecular weight of 237.35 g/mol, XLogP of 1.66, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylaminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine is sourced from PubChem (CID 62283072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).