4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine

C16H27N3 — CID 63329410

IUPAC4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine
SMILESCCCN1CCCC(C(C)Nc2cnccc2C)C1
InChIInChI=1S/C16H27N3/c1-4-9-19-10-5-6-15(12-19)14(3)18-16-11-17-8-7-13(16)2/h7-8,11,14-15,18H,4-6,9-10,12H2,1-3H3
InChIKeyIMHYSXNFGHSOQW-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.31
Rot. Bonds5

About 4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine

4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine (PubChem CID 63329410) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine.

Molecular Properties

Compound Name4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine
PubChem CID63329410
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC Name4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine
SMILESCCCN1CCCC(C(C)Nc2cnccc2C)C1
InChIInChI=1S/C16H27N3/c1-4-9-19-10-5-6-15(12-19)14(3)18-16-11-17-8-7-13(16)2/h7-8,11,14-15,18H,4-6,9-10,12H2,1-3H3
InChIKeyIMHYSXNFGHSOQW-UHFFFAOYSA-N
XLogP3.31
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine?
The IUPAC name of 4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine (CID 63329410) is 4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine.
What is the SMILES notation for 4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine?
The canonical SMILES for 4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine is CCCN1CCCC(C(C)Nc2cnccc2C)C1.
What is the InChIKey of 4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine?
The InChIKey is IMHYSXNFGHSOQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-4-9-19-10-5-6-15(12-19)14(3)18-16-11-17-8-7-13(16)2/h7-8,11,14-15,18H,4-6,9-10,12H2,1-3H3.
What are the key properties of 4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine?
4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine has a molecular weight of 261.41 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]pyridin-3-amine is sourced from PubChem (CID 63329410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).