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

C13H23N3 — CID 62183438

IUPAC5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ccc(CN(C)CCC)cn1
InChIInChI=1S/C13H23N3/c1-4-8-14-13-7-6-12(10-15-13)11-16(3)9-5-2/h6-7,10H,4-5,8-9,11H2,1-3H3,(H,14,15)
InChIKeyUTPGRPUMVQWTEW-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.75
Rot. Bonds7

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

5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine (PubChem CID 62183438) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine
PubChem CID62183438
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ccc(CN(C)CCC)cn1
InChIInChI=1S/C13H23N3/c1-4-8-14-13-7-6-12(10-15-13)11-16(3)9-5-2/h6-7,10H,4-5,8-9,11H2,1-3H3,(H,14,15)
InChIKeyUTPGRPUMVQWTEW-UHFFFAOYSA-N
XLogP2.75
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N,N'-trimethyl-N'-[[6-(propylamino)-3-pyridinyl]methyl]ethane-1,2-diamine
CID 63698946
5-[(dipropylamino)methyl]-N-propylpyridin-2-amine
CID 62183383
5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]-N-propylpyridin-2-amine
CID 62183942
5-[[cyclobutylmethyl(methyl)amino]methyl]-N-propylpyridin-2-amine
CID 62861753
5-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine
CID 62207430
2-[ethyl-[[6-(propylamino)-3-pyridinyl]methyl]amino]ethanol
CID 62182263
5-[(N,2-dimethylanilino)methyl]-N-propylpyridin-2-amine
CID 62209613
5-[[methyl(oxolan-2-ylmethyl)amino]methyl]-N-propylpyridin-2-amine
CID 62207861
5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine
CID 62209615
5-[[1-cyclopropylethyl(methyl)amino]methyl]-N-propylpyridin-2-amine
CID 62182940
4-[methyl-[[6-(propylamino)-3-pyridinyl]methyl]amino]benzonitrile
CID 62981948
5-[[methyl(oxan-3-ylmethyl)amino]methyl]-N-propylpyridin-2-amine
CID 63711460

Frequently Asked Questions

What is the IUPAC name of 5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine?
The IUPAC name of 5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine (CID 62183438) is 5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine?
The canonical SMILES for 5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine is CCCNc1ccc(CN(C)CCC)cn1.
What is the InChIKey of 5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine?
The InChIKey is UTPGRPUMVQWTEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-4-8-14-13-7-6-12(10-15-13)11-16(3)9-5-2/h6-7,10H,4-5,8-9,11H2,1-3H3,(H,14,15).
What are the key properties of 5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine?
5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine has a molecular weight of 221.35 g/mol, XLogP of 2.75, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 62183438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).