5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine

C15H25N3 — CID 62182940

IUPAC5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ccc(CN(C)C(C)C2CC2)cn1
InChIInChI=1S/C15H25N3/c1-4-9-16-15-8-5-13(10-17-15)11-18(3)12(2)14-6-7-14/h5,8,10,12,14H,4,6-7,9,11H2,1-3H3,(H,16,17)
InChIKeyJTCNTPMDLQLRSG-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.13
Rot. Bonds7

About 5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine

5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine (PubChem CID 62182940) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine
PubChem CID62182940
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ccc(CN(C)C(C)C2CC2)cn1
InChIInChI=1S/C15H25N3/c1-4-9-16-15-8-5-13(10-17-15)11-18(3)12(2)14-6-7-14/h5,8,10,12,14H,4,6-7,9,11H2,1-3H3,(H,16,17)
InChIKeyJTCNTPMDLQLRSG-UHFFFAOYSA-N
XLogP3.13
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine?
The IUPAC name of 5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine (CID 62182940) is 5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine?
The canonical SMILES for 5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine is CCCNc1ccc(CN(C)C(C)C2CC2)cn1.
What is the InChIKey of 5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine?
The InChIKey is JTCNTPMDLQLRSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-9-16-15-8-5-13(10-17-15)11-18(3)12(2)14-6-7-14/h5,8,10,12,14H,4,6-7,9,11H2,1-3H3,(H,16,17).
What are the key properties of 5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine?
5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine has a molecular weight of 247.39 g/mol, XLogP of 3.13, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 62182940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).