N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide

C17H30N2O — CID 83031256

IUPACN-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide
SMILESCC(C)(C(=O)NCC1CC2CCC1C2)C1CCCNC1
InChIInChI=1S/C17H30N2O/c1-17(2,15-4-3-7-18-11-15)16(20)19-10-14-9-12-5-6-13(14)8-12/h12-15,18H,3-11H2,1-2H3,(H,19,20)
InChIKeyQHPHCTLFELAQPS-UHFFFAOYSA-N
MW278.44 g/mol
LogP2.56
Rot. Bonds4

About N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide

N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide (PubChem CID 83031256) has the molecular formula C17H30N2O and a molecular weight of 278.44 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide
PubChem CID83031256
Molecular FormulaC17H30N2O
Molecular Weight278.44 g/mol
Exact Mass278.24
IUPAC NameN-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide
SMILESCC(C)(C(=O)NCC1CC2CCC1C2)C1CCCNC1
InChIInChI=1S/C17H30N2O/c1-17(2,15-4-3-7-18-11-15)16(20)19-10-14-9-12-5-6-13(14)8-12/h12-15,18H,3-11H2,1-2H3,(H,19,20)
InChIKeyQHPHCTLFELAQPS-UHFFFAOYSA-N
XLogP2.56
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[(2-methyl-2-piperidin-3-ylpropanoyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 83199902
2,2-dimethyl-3-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]propanamide
CID 103884926
2-methyl-N-(2-methylpropyl)-2-piperidin-3-ylpropanamide
CID 83032464
N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83031263
2-methyl-3-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]propanoic acid
CID 83198731
N,2-dimethyl-2-piperidin-3-ylpropanamide
CID 83031239
5-[[(2-methyl-2-piperidin-3-ylpropanoyl)amino]methyl]oxolane-2-carboxylic acid
CID 83199780
N-[2-(diethylamino)ethyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83031262
2-methyl-N-(2-methylcyclopropyl)-2-piperidin-3-ylpropanamide
CID 83031438
2-methyl-N-(2-methylbutan-2-yl)-2-piperidin-3-ylpropanamide
CID 83199732
2-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methylbutanamide
CID 114290714
2-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]-2-piperidin-3-ylpropanamide
CID 115881604

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide (CID 83031256) is N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide is CC(C)(C(=O)NCC1CC2CCC1C2)C1CCCNC1.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide?
The InChIKey is QHPHCTLFELAQPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O/c1-17(2,15-4-3-7-18-11-15)16(20)19-10-14-9-12-5-6-13(14)8-12/h12-15,18H,3-11H2,1-2H3,(H,19,20).
What are the key properties of N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide?
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide has a molecular weight of 278.44 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methyl-2-piperidin-3-ylpropanamide is sourced from PubChem (CID 83031256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).