1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine

C15H27N3 — CID 154101987

IUPAC1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine
SMILESCC1(C)CCCN(C(C)(C)N2C=CC=CC2N)C1
InChIInChI=1S/C15H27N3/c1-14(2)9-7-10-17(12-14)15(3,4)18-11-6-5-8-13(18)16/h5-6,8,11,13H,7,9-10,12,16H2,1-4H3
InChIKeyKXKXVDXSCNJGPC-UHFFFAOYSA-N
MW249.40 g/mol
LogP2.51
Rot. Bonds2

About 1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine

1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine (PubChem CID 154101987) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine.

Molecular Properties

Compound Name1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine
PubChem CID154101987
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine
SMILESCC1(C)CCCN(C(C)(C)N2C=CC=CC2N)C1
InChIInChI=1S/C15H27N3/c1-14(2)9-7-10-17(12-14)15(3,4)18-11-6-5-8-13(18)16/h5-6,8,11,13H,7,9-10,12,16H2,1-4H3
InChIKeyKXKXVDXSCNJGPC-UHFFFAOYSA-N
XLogP2.51
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine?
The IUPAC name of 1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine (CID 154101987) is 1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine.
What is the SMILES notation for 1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine?
The canonical SMILES for 1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine is CC1(C)CCCN(C(C)(C)N2C=CC=CC2N)C1.
What is the InChIKey of 1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine?
The InChIKey is KXKXVDXSCNJGPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-14(2)9-7-10-17(12-14)15(3,4)18-11-6-5-8-13(18)16/h5-6,8,11,13H,7,9-10,12,16H2,1-4H3.
What are the key properties of 1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine?
1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine has a molecular weight of 249.40 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-2H-pyridin-2-amine is sourced from PubChem (CID 154101987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).