5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine

C12H21N3 — CID 102545297

IUPAC5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine
SMILESCCCNc1cc(C)c(C(N)CC)cn1
InChIInChI=1S/C12H21N3/c1-4-6-14-12-7-9(3)10(8-15-12)11(13)5-2/h7-8,11H,4-6,13H2,1-3H3,(H,14,15)
InChIKeyBPRFWKNDRMFCLH-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.62
Rot. Bonds5

About 5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine

5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine (PubChem CID 102545297) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine.

Molecular Properties

Compound Name5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine
PubChem CID102545297
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine
SMILESCCCNc1cc(C)c(C(N)CC)cn1
InChIInChI=1S/C12H21N3/c1-4-6-14-12-7-9(3)10(8-15-12)11(13)5-2/h7-8,11H,4-6,13H2,1-3H3,(H,14,15)
InChIKeyBPRFWKNDRMFCLH-UHFFFAOYSA-N
XLogP2.62
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(1S)-1-aminopropyl]-4-methyl-N-propylpyridin-2-amine
CID 124501813
5-[(1S)-1-aminoethyl]-4-methyl-N-propylpyridin-2-amine
CID 124501811
5-(1-aminoethyl)-4-methyl-N-propylpyridin-2-amine
CID 102545296
5-[(1S)-1-aminopropyl]-N-tert-butyl-4-methylpyridin-2-amine
CID 124502187
5-(chloromethyl)-4-methyl-N-propylpyridin-2-amine
CID 102545284
5-(aminomethyl)-4-methyl-N-propylpyridin-2-amine
CID 102545289
5-(1-aminopropyl)-N-propylpyridin-2-amine
CID 102546615
5-[(1R)-1-aminopropyl]-4-methylpyridin-2-amine
CID 55275674
[4-methyl-6-(propylamino)-3-pyridinyl]-phenylmethanol
CID 102545295
(S)-[4-methyl-6-(propylamino)-3-pyridinyl]-phenylmethanol
CID 124501809
(1R)-1-(6-chloro-4-methyl-3-pyridinyl)propan-1-amine
CID 55273612
(1S)-1-(6-bromo-4-methyl-3-pyridinyl)propan-1-amine
CID 124501686

Frequently Asked Questions

What is the IUPAC name of 5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine?
The IUPAC name of 5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine (CID 102545297) is 5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine.
What is the SMILES notation for 5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine?
The canonical SMILES for 5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine is CCCNc1cc(C)c(C(N)CC)cn1.
What is the InChIKey of 5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine?
The InChIKey is BPRFWKNDRMFCLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-4-6-14-12-7-9(3)10(8-15-12)11(13)5-2/h7-8,11H,4-6,13H2,1-3H3,(H,14,15).
What are the key properties of 5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine?
5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine has a molecular weight of 207.32 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-aminopropyl)-4-methyl-N-propylpyridin-2-amine is sourced from PubChem (CID 102545297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).