N-tert-butylpiperidine-3-carboxamide

C10H20N2O — CID 18072694

IUPACN-tert-butylpiperidine-3-carboxamide
SMILESCC(C)(C)NC(=O)C1CCCNC1
InChIInChI=1S/C10H20N2O/c1-10(2,3)12-9(13)8-5-4-6-11-7-8/h8,11H,4-7H2,1-3H3,(H,12,13)
InChIKeyBSCHGEGCEXMNMO-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.90
Rot. Bonds1

About N-tert-butylpiperidine-3-carboxamide

N-tert-butylpiperidine-3-carboxamide (PubChem CID 18072694) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-tert-butylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-tert-butylpiperidine-3-carboxamide
PubChem CID18072694
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-tert-butylpiperidine-3-carboxamide
SMILESCC(C)(C)NC(=O)C1CCCNC1
InChIInChI=1S/C10H20N2O/c1-10(2,3)12-9(13)8-5-4-6-11-7-8/h8,11H,4-7H2,1-3H3,(H,12,13)
InChIKeyBSCHGEGCEXMNMO-UHFFFAOYSA-N
XLogP0.90
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-tert-butylpiperidine-3-carboxamide?
The IUPAC name of N-tert-butylpiperidine-3-carboxamide (CID 18072694) is N-tert-butylpiperidine-3-carboxamide.
What is the SMILES notation for N-tert-butylpiperidine-3-carboxamide?
The canonical SMILES for N-tert-butylpiperidine-3-carboxamide is CC(C)(C)NC(=O)C1CCCNC1.
What is the InChIKey of N-tert-butylpiperidine-3-carboxamide?
The InChIKey is BSCHGEGCEXMNMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-10(2,3)12-9(13)8-5-4-6-11-7-8/h8,11H,4-7H2,1-3H3,(H,12,13).
What are the key properties of N-tert-butylpiperidine-3-carboxamide?
N-tert-butylpiperidine-3-carboxamide has a molecular weight of 184.28 g/mol, XLogP of 0.90, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butylpiperidine-3-carboxamide is sourced from PubChem (CID 18072694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).