2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine

C14H30N2 — CID 62204904

IUPAC2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine
SMILESCCCC1CCN(CC(C)(N)CCC)CC1
InChIInChI=1S/C14H30N2/c1-4-6-13-7-10-16(11-8-13)12-14(3,15)9-5-2/h13H,4-12,15H2,1-3H3
InChIKeyYMHDEJNKEMYQEA-UHFFFAOYSA-N
MW226.41 g/mol
LogP3.02
Rot. Bonds6

About 2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine

2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine (PubChem CID 62204904) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine.

Molecular Properties

Compound Name2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine
PubChem CID62204904
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine
SMILESCCCC1CCN(CC(C)(N)CCC)CC1
InChIInChI=1S/C14H30N2/c1-4-6-13-7-10-16(11-8-13)12-14(3,15)9-5-2/h13H,4-12,15H2,1-3H3
InChIKeyYMHDEJNKEMYQEA-UHFFFAOYSA-N
XLogP3.02
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine?
The IUPAC name of 2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine (CID 62204904) is 2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine.
What is the SMILES notation for 2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine?
The canonical SMILES for 2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine is CCCC1CCN(CC(C)(N)CCC)CC1.
What is the InChIKey of 2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine?
The InChIKey is YMHDEJNKEMYQEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-4-6-13-7-10-16(11-8-13)12-14(3,15)9-5-2/h13H,4-12,15H2,1-3H3.
What are the key properties of 2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine?
2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine has a molecular weight of 226.41 g/mol, XLogP of 3.02, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(4-propylpiperidin-1-yl)pentan-2-amine is sourced from PubChem (CID 62204904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).