N-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine

C15H25N3 — CID 113381366

IUPACN-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine
SMILESCCCc1cc(CNC)cc(N(C)CC2CC2)n1
InChIInChI=1S/C15H25N3/c1-4-5-14-8-13(10-16-2)9-15(17-14)18(3)11-12-6-7-12/h8-9,12,16H,4-7,10-11H2,1-3H3
InChIKeyJPBUFMJMHWQCAQ-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.60
Rot. Bonds7

About N-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine

N-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine (PubChem CID 113381366) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine
PubChem CID113381366
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine
SMILESCCCc1cc(CNC)cc(N(C)CC2CC2)n1
InChIInChI=1S/C15H25N3/c1-4-5-14-8-13(10-16-2)9-15(17-14)18(3)11-12-6-7-12/h8-9,12,16H,4-7,10-11H2,1-3H3
InChIKeyJPBUFMJMHWQCAQ-UHFFFAOYSA-N
XLogP2.60
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 ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine?
The IUPAC name of N-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine (CID 113381366) is N-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine?
The canonical SMILES for N-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine is CCCc1cc(CNC)cc(N(C)CC2CC2)n1.
What is the InChIKey of N-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine?
The InChIKey is JPBUFMJMHWQCAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-5-14-8-13(10-16-2)9-15(17-14)18(3)11-12-6-7-12/h8-9,12,16H,4-7,10-11H2,1-3H3.
What are the key properties of N-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine?
N-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine has a molecular weight of 247.39 g/mol, XLogP of 2.60, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-methyl-4-(methylaminomethyl)-6-propylpyridin-2-amine is sourced from PubChem (CID 113381366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).