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

C8H18N2O — CID 7183117

IUPAC(3S)-1-(3-aminopropyl)piperidin-3-ol
SMILESNCCCN1CCC[C@H](O)C1
InChIInChI=1S/C8H18N2O/c9-4-2-6-10-5-1-3-8(11)7-10/h8,11H,1-7,9H2/t8-/m0/s1
InChIKeyRLDCHEDVXUZUMM-QMMMGPOBSA-N
MW158.24 g/mol
LogP-0.21
Rot. Bonds3

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

(3S)-1-(3-aminopropyl)piperidin-3-ol (PubChem CID 7183117) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is (3S)-1-(3-aminopropyl)piperidin-3-ol.

Molecular Properties

Compound Name(3S)-1-(3-aminopropyl)piperidin-3-ol
PubChem CID7183117
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name(3S)-1-(3-aminopropyl)piperidin-3-ol
SMILESNCCCN1CCC[C@H](O)C1
InChIInChI=1S/C8H18N2O/c9-4-2-6-10-5-1-3-8(11)7-10/h8,11H,1-7,9H2/t8-/m0/s1
InChIKeyRLDCHEDVXUZUMM-QMMMGPOBSA-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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Related Compounds

1-(4-aminobutyl)pyrrolidin-3-ol
CID 18550500
(3S)-1-[3-[3-[(3S)-3-hydroxypiperidin-1-yl]propoxy]propyl]piperidin-3-ol
CID 142756274
1-(3-morpholin-4-ylpropyl)piperidin-3-ol
CID 111461736
1-(2-hydrazinylethyl)piperidin-3-ol
CID 130124439
4-(3-hydroxypiperidin-1-yl)butanehydrazide
CID 63585558
1-(5-methoxypentyl)piperidin-3-ol
CID 110932736
1-(3-amino-3-methylbutyl)piperidin-3-ol
CID 82405665
1-(2-aminoethyl)pyrrolidin-3-ol;ethane
CID 145171245
4-(3-hydroxypiperidin-1-yl)-N-methylbutanamide
CID 63892540
(3R,4S)-1-(3-aminopropyl)-3-(cyclopropylmethyl)piperidin-4-ol
CID 129497955
1-(chloromethyl)piperidin-3-ol
CID 53403087
methyl 1-(3-aminopropyl)piperidine-3-carboxylate
CID 115533707

Frequently Asked Questions

What is the IUPAC name of (3S)-1-(3-aminopropyl)piperidin-3-ol?
The IUPAC name of (3S)-1-(3-aminopropyl)piperidin-3-ol (CID 7183117) is (3S)-1-(3-aminopropyl)piperidin-3-ol.
What is the SMILES notation for (3S)-1-(3-aminopropyl)piperidin-3-ol?
The canonical SMILES for (3S)-1-(3-aminopropyl)piperidin-3-ol is NCCCN1CCC[C@H](O)C1.
What is the InChIKey of (3S)-1-(3-aminopropyl)piperidin-3-ol?
The InChIKey is RLDCHEDVXUZUMM-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H18N2O/c9-4-2-6-10-5-1-3-8(11)7-10/h8,11H,1-7,9H2/t8-/m0/s1.
What are the key properties of (3S)-1-(3-aminopropyl)piperidin-3-ol?
(3S)-1-(3-aminopropyl)piperidin-3-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 (3S)-1-(3-aminopropyl)piperidin-3-ol is sourced from PubChem (CID 7183117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).