N-[(3S)-piperidin-3-yl]piperidine-1-carboxamide

C11H21N3O — CID 104982501

IUPACN-[(3S)-piperidin-3-yl]piperidine-1-carboxamide
SMILESO=C(N[C@H]1CCCNC1)N1CCCCC1
InChIInChI=1S/C11H21N3O/c15-11(14-7-2-1-3-8-14)13-10-5-4-6-12-9-10/h10,12H,1-9H2,(H,13,15)/t10-/m0/s1
InChIKeyCFJVULUUKVBCBH-JTQLQIEISA-N
MW211.31 g/mol
LogP0.93
Rot. Bonds1

About N-[(3S)-piperidin-3-yl]piperidine-1-carboxamide

N-[(3S)-piperidin-3-yl]piperidine-1-carboxamide (PubChem CID 104982501) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is N-[(3S)-piperidin-3-yl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(3S)-piperidin-3-yl]piperidine-1-carboxamide
PubChem CID104982501
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC NameN-[(3S)-piperidin-3-yl]piperidine-1-carboxamide
SMILESO=C(N[C@H]1CCCNC1)N1CCCCC1
InChIInChI=1S/C11H21N3O/c15-11(14-7-2-1-3-8-14)13-10-5-4-6-12-9-10/h10,12H,1-9H2,(H,13,15)/t10-/m0/s1
InChIKeyCFJVULUUKVBCBH-JTQLQIEISA-N
XLogP0.93
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(3S)-piperidin-3-yl]piperidine-1-carboxamide?
The IUPAC name of N-[(3S)-piperidin-3-yl]piperidine-1-carboxamide (CID 104982501) is N-[(3S)-piperidin-3-yl]piperidine-1-carboxamide.
What is the SMILES notation for N-[(3S)-piperidin-3-yl]piperidine-1-carboxamide?
The canonical SMILES for N-[(3S)-piperidin-3-yl]piperidine-1-carboxamide is O=C(N[C@H]1CCCNC1)N1CCCCC1.
What is the InChIKey of N-[(3S)-piperidin-3-yl]piperidine-1-carboxamide?
The InChIKey is CFJVULUUKVBCBH-JTQLQIEISA-N. The full InChI is InChI=1S/C11H21N3O/c15-11(14-7-2-1-3-8-14)13-10-5-4-6-12-9-10/h10,12H,1-9H2,(H,13,15)/t10-/m0/s1.
What are the key properties of N-[(3S)-piperidin-3-yl]piperidine-1-carboxamide?
N-[(3S)-piperidin-3-yl]piperidine-1-carboxamide has a molecular weight of 211.31 g/mol, XLogP of 0.93, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-piperidin-3-yl]piperidine-1-carboxamide is sourced from PubChem (CID 104982501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).