2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol

C12H26N2O — CID 60885686

IUPAC2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol
SMILESCCCNC1CCN(CC(C)(C)O)CC1
InChIInChI=1S/C12H26N2O/c1-4-7-13-11-5-8-14(9-6-11)10-12(2,3)15/h11,13,15H,4-10H2,1-3H3
InChIKeyBYAQDIPSJNZYBA-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.22
Rot. Bonds5

About 2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol

2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol (PubChem CID 60885686) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol
PubChem CID60885686
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol
SMILESCCCNC1CCN(CC(C)(C)O)CC1
InChIInChI=1S/C12H26N2O/c1-4-7-13-11-5-8-14(9-6-11)10-12(2,3)15/h11,13,15H,4-10H2,1-3H3
InChIKeyBYAQDIPSJNZYBA-UHFFFAOYSA-N
XLogP1.22
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol?
The IUPAC name of 2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol (CID 60885686) is 2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol.
What is the SMILES notation for 2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol?
The canonical SMILES for 2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol is CCCNC1CCN(CC(C)(C)O)CC1.
What is the InChIKey of 2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol?
The InChIKey is BYAQDIPSJNZYBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-7-13-11-5-8-14(9-6-11)10-12(2,3)15/h11,13,15H,4-10H2,1-3H3.
What are the key properties of 2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol?
2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol has a molecular weight of 214.35 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[4-(propylamino)piperidin-1-yl]propan-2-ol is sourced from PubChem (CID 60885686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).