N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide

C16H28N2O — CID 106625572

IUPACN-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide
SMILESCCCN(CC1CCCCN1)C(=O)C1CC2CC2C1
InChIInChI=1S/C16H28N2O/c1-2-7-18(11-15-5-3-4-6-17-15)16(19)14-9-12-8-13(12)10-14/h12-15,17H,2-11H2,1H3
InChIKeyFYUHYJXJLVJJQP-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.41
Rot. Bonds5

About N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide

N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide (PubChem CID 106625572) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide.

Molecular Properties

Compound NameN-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide
PubChem CID106625572
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC NameN-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide
SMILESCCCN(CC1CCCCN1)C(=O)C1CC2CC2C1
InChIInChI=1S/C16H28N2O/c1-2-7-18(11-15-5-3-4-6-17-15)16(19)14-9-12-8-13(12)10-14/h12-15,17H,2-11H2,1H3
InChIKeyFYUHYJXJLVJJQP-UHFFFAOYSA-N
XLogP2.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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

N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide
CID 106625676
N-propyl-N-(pyrrolidin-2-ylmethyl)cyclobutanecarboxamide
CID 106610516
1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide
CID 106625670
N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)bicyclo[3.1.0]hexane-3-carboxamide
CID 106611032
2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide
CID 106625536
N-propyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106610345
2,2-difluoro-N-(piperidin-2-ylmethyl)-N-propylacetamide
CID 106625526
2-cycloheptyl-N-(piperidin-2-ylmethyl)-N-propylacetamide
CID 106625612
N-propyl-N-(pyrrolidin-2-ylmethyl)propanamide
CID 106610515
5-methyl-N-propyl-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide
CID 106610382
N-butyl-N-(pyrrolidin-2-ylmethyl)cyclopent-3-ene-1-carboxamide
CID 106612077
N-(2-hydroxyethyl)-4-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexane-1-carboxamide
CID 106612534

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide?
The IUPAC name of N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide (CID 106625572) is N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide.
What is the SMILES notation for N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide?
The canonical SMILES for N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide is CCCN(CC1CCCCN1)C(=O)C1CC2CC2C1.
What is the InChIKey of N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide?
The InChIKey is FYUHYJXJLVJJQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-2-7-18(11-15-5-3-4-6-17-15)16(19)14-9-12-8-13(12)10-14/h12-15,17H,2-11H2,1H3.
What are the key properties of N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide?
N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide has a molecular weight of 264.41 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide is sourced from PubChem (CID 106625572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).