N-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide

C16H28N2O — CID 60807755

IUPACN-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide
SMILESCCCN(C(=O)C1CC2CCC1C2)C1CCCNC1
InChIInChI=1S/C16H28N2O/c1-2-8-18(14-4-3-7-17-11-14)16(19)15-10-12-5-6-13(15)9-12/h12-15,17H,2-11H2,1H3
InChIKeyROSAJZCQWULOLY-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.41
Rot. Bonds4

About N-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide

N-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide (PubChem CID 60807755) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is N-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide.

Molecular Properties

Compound NameN-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide
PubChem CID60807755
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC NameN-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide
SMILESCCCN(C(=O)C1CC2CCC1C2)C1CCCNC1
InChIInChI=1S/C16H28N2O/c1-2-8-18(14-4-3-7-17-11-14)16(19)15-10-12-5-6-13(15)9-12/h12-15,17H,2-11H2,1H3
InChIKeyROSAJZCQWULOLY-UHFFFAOYSA-N
XLogP2.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-piperidin-3-yl-N-propylcyclopropane-1-carboxamide
CID 60807764
N-methyl-N-piperidin-3-ylbicyclo[2.2.1]heptane-2-carboxamide
CID 60807056
(2R)-N-piperidin-3-yl-N-propyloxolane-2-carboxamide
CID 104856269
5-oxo-N-piperidin-3-yl-N-propylpyrrolidine-3-carboxamide
CID 83192629
2-cyclopentyl-N-piperidin-3-yl-N-propylacetamide
CID 60805879
N-(3-bromopropyl)-N-cyclobutylbicyclo[2.2.1]heptane-2-carboxamide
CID 102872445
N-piperidin-3-yl-N-propyldecanamide
CID 65450246
2-methyl-N-piperidin-4-yl-N-propylcyclopropane-1-carboxamide
CID 60806583
(3R)-N-butyl-N-cyclopropylpiperidine-3-carboxamide
CID 81129307
3-phenyl-N-piperidin-3-yl-N-propylprop-2-enamide
CID 77002821
N-ethyl-2-methyl-N-pyrrolidin-3-ylcyclopentane-1-carboxamide
CID 107176120
2-(4-methylphenyl)-N-piperidin-3-yl-N-propylacetamide
CID 60799979

Frequently Asked Questions

What is the IUPAC name of N-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide?
The IUPAC name of N-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide (CID 60807755) is N-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide.
What is the SMILES notation for N-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide?
The canonical SMILES for N-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide is CCCN(C(=O)C1CC2CCC1C2)C1CCCNC1.
What is the InChIKey of N-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide?
The InChIKey is ROSAJZCQWULOLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-2-8-18(14-4-3-7-17-11-14)16(19)15-10-12-5-6-13(15)9-12/h12-15,17H,2-11H2,1H3.
What are the key properties of N-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide?
N-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide has a molecular weight of 264.41 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-3-yl-N-propylbicyclo[2.2.1]heptane-2-carboxamide is sourced from PubChem (CID 60807755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).