4-methyl-N-propyl-3H-pyridin-4-amine

C9H16N2 — CID 129019426

IUPAC4-methyl-N-propyl-3H-pyridin-4-amine
SMILESCCCNC1(C)C=CN=CC1
InChIInChI=1S/C9H16N2/c1-3-6-11-9(2)4-7-10-8-5-9/h4,7-8,11H,3,5-6H2,1-2H3
InChIKeyDEELXCICWPWOGJ-UHFFFAOYSA-N
MW152.24 g/mol
LogP1.73
Rot. Bonds3

About 4-methyl-N-propyl-3H-pyridin-4-amine

4-methyl-N-propyl-3H-pyridin-4-amine (PubChem CID 129019426) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 4-methyl-N-propyl-3H-pyridin-4-amine.

Molecular Properties

Compound Name4-methyl-N-propyl-3H-pyridin-4-amine
PubChem CID129019426
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name4-methyl-N-propyl-3H-pyridin-4-amine
SMILESCCCNC1(C)C=CN=CC1
InChIInChI=1S/C9H16N2/c1-3-6-11-9(2)4-7-10-8-5-9/h4,7-8,11H,3,5-6H2,1-2H3
InChIKeyDEELXCICWPWOGJ-UHFFFAOYSA-N
XLogP1.73
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-propyl-3H-pyridin-4-amine?
The IUPAC name of 4-methyl-N-propyl-3H-pyridin-4-amine (CID 129019426) is 4-methyl-N-propyl-3H-pyridin-4-amine.
What is the SMILES notation for 4-methyl-N-propyl-3H-pyridin-4-amine?
The canonical SMILES for 4-methyl-N-propyl-3H-pyridin-4-amine is CCCNC1(C)C=CN=CC1.
What is the InChIKey of 4-methyl-N-propyl-3H-pyridin-4-amine?
The InChIKey is DEELXCICWPWOGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-3-6-11-9(2)4-7-10-8-5-9/h4,7-8,11H,3,5-6H2,1-2H3.
What are the key properties of 4-methyl-N-propyl-3H-pyridin-4-amine?
4-methyl-N-propyl-3H-pyridin-4-amine has a molecular weight of 152.24 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-propyl-3H-pyridin-4-amine is sourced from PubChem (CID 129019426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).