4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide

C9H19N3O2 — CID 43776407

IUPAC4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide
SMILESCC(CO)NC1CCN(C(N)=O)CC1
InChIInChI=1S/C9H19N3O2/c1-7(6-13)11-8-2-4-12(5-3-8)9(10)14/h7-8,11,13H,2-6H2,1H3,(H2,10,14)
InChIKeyYFEATSYFSAPCHG-UHFFFAOYSA-N
MW201.27 g/mol
LogP-0.50
Rot. Bonds3

About 4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide

4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide (PubChem CID 43776407) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide
PubChem CID43776407
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC Name4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide
SMILESCC(CO)NC1CCN(C(N)=O)CC1
InChIInChI=1S/C9H19N3O2/c1-7(6-13)11-8-2-4-12(5-3-8)9(10)14/h7-8,11,13H,2-6H2,1H3,(H2,10,14)
InChIKeyYFEATSYFSAPCHG-UHFFFAOYSA-N
XLogP-0.50
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide?
The IUPAC name of 4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide (CID 43776407) is 4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide.
What is the SMILES notation for 4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide?
The canonical SMILES for 4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide is CC(CO)NC1CCN(C(N)=O)CC1.
What is the InChIKey of 4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide?
The InChIKey is YFEATSYFSAPCHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-7(6-13)11-8-2-4-12(5-3-8)9(10)14/h7-8,11,13H,2-6H2,1H3,(H2,10,14).
What are the key properties of 4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide?
4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide has a molecular weight of 201.27 g/mol, XLogP of -0.50, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide is sourced from PubChem (CID 43776407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).