N-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide

C8H16N2O2 — CID 88885612

IUPACN-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide
SMILESO=CNCCN1CCCC(O)C1
InChIInChI=1S/C8H16N2O2/c11-7-9-3-5-10-4-1-2-8(12)6-10/h7-8,12H,1-6H2,(H,9,11)
InChIKeyVPHNRSCBPRWGHE-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.81
Rot. Bonds4

About N-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide

N-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide (PubChem CID 88885612) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is N-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide.

Molecular Properties

Compound NameN-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide
PubChem CID88885612
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC NameN-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide
SMILESO=CNCCN1CCCC(O)C1
InChIInChI=1S/C8H16N2O2/c11-7-9-3-5-10-4-1-2-8(12)6-10/h7-8,12H,1-6H2,(H,9,11)
InChIKeyVPHNRSCBPRWGHE-UHFFFAOYSA-N
XLogP-0.81
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2-hydrazinylethyl)piperidin-3-ol
CID 130124439
2-(3-hydroxypiperidin-1-yl)acetaldehyde
CID 62035044
4-(3-hydroxypiperidin-1-yl)butanehydrazide
CID 63585558
4-(3-hydroxypiperidin-1-yl)-N-methylbutanamide
CID 63892540
(3S)-1-(3-aminopropyl)piperidin-3-ol
CID 7183117
(3S)-1-[3-[3-[(3S)-3-hydroxypiperidin-1-yl]propoxy]propyl]piperidin-3-ol
CID 142756274
N-[2-[4-(dicyclopropylamino)piperidin-1-yl]ethyl]formamide
CID 54260066
1-(chloromethyl)piperidin-3-ol
CID 53403087
3-[3-(3-hydroxypiperidin-1-yl)propylcarbamoylamino]propanoic acid
CID 131931427
(3R)-1-[3-(pentan-3-ylamino)propyl]piperidin-3-ol
CID 95120625
2-ethyl-2-[(3-hydroxypiperidin-1-yl)methyl]butanal
CID 62275701
4-chloro-N-[2-(3-hydroxypiperidin-1-yl)ethyl]benzenesulfonamide
CID 57202265

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide?
The IUPAC name of N-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide (CID 88885612) is N-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide.
What is the SMILES notation for N-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide?
The canonical SMILES for N-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide is O=CNCCN1CCCC(O)C1.
What is the InChIKey of N-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide?
The InChIKey is VPHNRSCBPRWGHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c11-7-9-3-5-10-4-1-2-8(12)6-10/h7-8,12H,1-6H2,(H,9,11).
What are the key properties of N-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide?
N-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide has a molecular weight of 172.23 g/mol, XLogP of -0.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-hydroxypiperidin-1-yl)ethyl]formamide is sourced from PubChem (CID 88885612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).