1-(3-aminopropyl)piperidin-4-ol

C8H18N2O — CID 4712468

IUPAC1-(3-aminopropyl)piperidin-4-ol
SMILESNCCCN1CCC(O)CC1
InChIInChI=1S/C8H18N2O/c9-4-1-5-10-6-2-8(11)3-7-10/h8,11H,1-7,9H2
InChIKeyBNUCAKHAFXRILR-UHFFFAOYSA-N
MW158.24 g/mol
LogP-0.21
Rot. Bonds3

About 1-(3-aminopropyl)piperidin-4-ol

1-(3-aminopropyl)piperidin-4-ol (PubChem CID 4712468) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 1-(3-aminopropyl)piperidin-4-ol.

Molecular Properties

Compound Name1-(3-aminopropyl)piperidin-4-ol
PubChem CID4712468
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name1-(3-aminopropyl)piperidin-4-ol
SMILESNCCCN1CCC(O)CC1
InChIInChI=1S/C8H18N2O/c9-4-1-5-10-6-2-8(11)3-7-10/h8,11H,1-7,9H2
InChIKeyBNUCAKHAFXRILR-UHFFFAOYSA-N
XLogP-0.21
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-aminopropyl)piperidin-4-ol?
The IUPAC name of 1-(3-aminopropyl)piperidin-4-ol (CID 4712468) is 1-(3-aminopropyl)piperidin-4-ol.
What is the SMILES notation for 1-(3-aminopropyl)piperidin-4-ol?
The canonical SMILES for 1-(3-aminopropyl)piperidin-4-ol is NCCCN1CCC(O)CC1.
What is the InChIKey of 1-(3-aminopropyl)piperidin-4-ol?
The InChIKey is BNUCAKHAFXRILR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c9-4-1-5-10-6-2-8(11)3-7-10/h8,11H,1-7,9H2.
What are the key properties of 1-(3-aminopropyl)piperidin-4-ol?
1-(3-aminopropyl)piperidin-4-ol has a molecular weight of 158.24 g/mol, XLogP of -0.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminopropyl)piperidin-4-ol is sourced from PubChem (CID 4712468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).