4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride

C13H27Cl2N3O2 — CID 119834916

IUPAC4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride
SMILESCCCN1CCC(NC(=O)C2CC(O)CN2)CC1.Cl.Cl
InChIInChI=1S/C13H25N3O2.2ClH/c1-2-5-16-6-3-10(4-7-16)15-13(18)12-8-11(17)9-14-12;;/h10-12,14,17H,2-9H2,1H3,(H,15,18);2*1H
InChIKeyOYEPILORTNRQMV-UHFFFAOYSA-N
MW328.28 g/mol
LogP0.54
Rot. Bonds4

About 4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride

4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride (PubChem CID 119834916) has the molecular formula C13H27Cl2N3O2 and a molecular weight of 328.28 g/mol. Its IUPAC name is 4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride.

Molecular Properties

Compound Name4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride
PubChem CID119834916
Molecular FormulaC13H27Cl2N3O2
Molecular Weight328.28 g/mol
Exact Mass327.15
IUPAC Name4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride
SMILESCCCN1CCC(NC(=O)C2CC(O)CN2)CC1.Cl.Cl
InChIInChI=1S/C13H25N3O2.2ClH/c1-2-5-16-6-3-10(4-7-16)15-13(18)12-8-11(17)9-14-12;;/h10-12,14,17H,2-9H2,1H3,(H,15,18);2*1H
InChIKeyOYEPILORTNRQMV-UHFFFAOYSA-N
XLogP0.54
TPSA64.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.28
LogP ≤ 50.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydroxy-N-[(1-propylpiperidin-4-yl)methyl]pyrrolidine-2-carboxamide;dihydrochloride
CID 119861445
(2R,4R)-N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-4-hydroxypyrrolidine-2-carboxamide
CID 124701668
(2R,4S)-N-[(3S)-1-ethylpiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide
CID 124832336
(2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide
CID 66855041
4-hydroxy-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide
CID 61212180
4-hydroxy-N-[4-(hydroxymethyl)cyclohexyl]pyrrolidine-2-carboxamide
CID 112753360
N-[1-(4-tert-butylphenyl)piperidin-4-yl]-4-hydroxypyrrolidine-2-carboxamide;dihydrochloride
CID 119862926
N-(3-ethylcyclohexyl)-4-hydroxypyrrolidine-2-carboxamide
CID 64748039
N-(1-butylpiperidin-4-yl)azepane-2-carboxamide
CID 64561841
3-amino-N-(1-propylpiperidin-4-yl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride
CID 119834897
4-hydroxy-N-(3-methylcyclohexyl)pyrrolidine-2-carboxamide
CID 43317965
(2R)-2-amino-N-(1-propylpiperidin-4-yl)propanamide;dihydrochloride
CID 119834920

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride?
The IUPAC name of 4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride (CID 119834916) is 4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride.
What is the SMILES notation for 4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride?
The canonical SMILES for 4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride is CCCN1CCC(NC(=O)C2CC(O)CN2)CC1.Cl.Cl.
What is the InChIKey of 4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride?
The InChIKey is OYEPILORTNRQMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2.2ClH/c1-2-5-16-6-3-10(4-7-16)15-13(18)12-8-11(17)9-14-12;;/h10-12,14,17H,2-9H2,1H3,(H,15,18);2*1H.
What are the key properties of 4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride?
4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride has a molecular weight of 328.28 g/mol, XLogP of 0.54, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride is sourced from PubChem (CID 119834916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).