2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine

C15H21N3O — CID 66414540

IUPAC2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine
SMILESCCCn1ccc(CNc2cccnc2OCC)c1
InChIInChI=1S/C15H21N3O/c1-3-9-18-10-7-13(12-18)11-17-14-6-5-8-16-15(14)19-4-2/h5-8,10,12,17H,3-4,9,11H2,1-2H3
InChIKeyVZEANWFKVRVZCY-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.30
Rot. Bonds7

About 2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine

2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine (PubChem CID 66414540) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine
PubChem CID66414540
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine
SMILESCCCn1ccc(CNc2cccnc2OCC)c1
InChIInChI=1S/C15H21N3O/c1-3-9-18-10-7-13(12-18)11-17-14-6-5-8-16-15(14)19-4-2/h5-8,10,12,17H,3-4,9,11H2,1-2H3
InChIKeyVZEANWFKVRVZCY-UHFFFAOYSA-N
XLogP3.30
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine
CID 66416306
2-ethoxy-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine
CID 66397464
2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine
CID 43706225
2-ethoxy-N-[(4-ethoxyphenyl)methyl]pyridin-3-amine
CID 43706214
N-[(3,5-dimethoxyphenyl)methyl]-2-ethoxypyridin-3-amine
CID 43706520
2,3-dichloro-N-[(1-propylpyrrol-3-yl)methyl]aniline
CID 66400502
2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine
CID 43706224
2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine
CID 60874271
2-ethoxy-N-[[4-(trifluoromethyl)phenyl]methyl]pyridin-3-amine
CID 43706278
N-[(1-propylpyrrol-3-yl)methyl]isoquinolin-5-amine
CID 66397773
2-ethoxy-N-[(4-propan-2-yloxyphenyl)methyl]pyridin-3-amine
CID 43784042
N-[2-[(1-propylpyrrol-3-yl)methylamino]phenyl]methanesulfonamide
CID 66414174

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine?
The IUPAC name of 2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine (CID 66414540) is 2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine.
What is the SMILES notation for 2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine?
The canonical SMILES for 2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine is CCCn1ccc(CNc2cccnc2OCC)c1.
What is the InChIKey of 2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine?
The InChIKey is VZEANWFKVRVZCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-3-9-18-10-7-13(12-18)11-17-14-6-5-8-16-15(14)19-4-2/h5-8,10,12,17H,3-4,9,11H2,1-2H3.
What are the key properties of 2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine?
2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine has a molecular weight of 259.35 g/mol, XLogP of 3.30, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 66414540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).