1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide

C14H25N3O3 — CID 119763378

IUPAC1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide
SMILESCCCNC(=O)C1CCCN(C(=O)C2CC(O)CN2)C1
InChIInChI=1S/C14H25N3O3/c1-2-5-15-13(19)10-4-3-6-17(9-10)14(20)12-7-11(18)8-16-12/h10-12,16,18H,2-9H2,1H3,(H,15,19)
InChIKeyJVAVKFGGQCZPGK-UHFFFAOYSA-N
MW283.37 g/mol
LogP-0.53
Rot. Bonds4

About 1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide

1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide (PubChem CID 119763378) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is 1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide
PubChem CID119763378
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC Name1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide
SMILESCCCNC(=O)C1CCCN(C(=O)C2CC(O)CN2)C1
InChIInChI=1S/C14H25N3O3/c1-2-5-15-13(19)10-4-3-6-17(9-10)14(20)12-7-11(18)8-16-12/h10-12,16,18H,2-9H2,1H3,(H,15,19)
InChIKeyJVAVKFGGQCZPGK-UHFFFAOYSA-N
XLogP-0.53
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 5-0.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide?
The IUPAC name of 1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide (CID 119763378) is 1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide?
The canonical SMILES for 1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide is CCCNC(=O)C1CCCN(C(=O)C2CC(O)CN2)C1.
What is the InChIKey of 1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide?
The InChIKey is JVAVKFGGQCZPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3/c1-2-5-15-13(19)10-4-3-6-17(9-10)14(20)12-7-11(18)8-16-12/h10-12,16,18H,2-9H2,1H3,(H,15,19).
What are the key properties of 1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide?
1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide has a molecular weight of 283.37 g/mol, XLogP of -0.53, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxypyrrolidine-2-carbonyl)-N-propylpiperidine-3-carboxamide is sourced from PubChem (CID 119763378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).