N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide

C15H26N2O — CID 79384307

IUPACN-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide
SMILESCC1NCCC1C(=O)N(C)CC1CC2CCC1C2
InChIInChI=1S/C15H26N2O/c1-10-14(5-6-16-10)15(18)17(2)9-13-8-11-3-4-12(13)7-11/h10-14,16H,3-9H2,1-2H3
InChIKeyTZPJZGXMGQMQHF-UHFFFAOYSA-N
MW250.39 g/mol
LogP1.88
Rot. Bonds3

About N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide

N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide (PubChem CID 79384307) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide
PubChem CID79384307
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide
SMILESCC1NCCC1C(=O)N(C)CC1CC2CCC1C2
InChIInChI=1S/C15H26N2O/c1-10-14(5-6-16-10)15(18)17(2)9-13-8-11-3-4-12(13)7-11/h10-14,16H,3-9H2,1-2H3
InChIKeyTZPJZGXMGQMQHF-UHFFFAOYSA-N
XLogP1.88
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide (CID 79384307) is N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide is CC1NCCC1C(=O)N(C)CC1CC2CCC1C2.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide?
The InChIKey is TZPJZGXMGQMQHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-10-14(5-6-16-10)15(18)17(2)9-13-8-11-3-4-12(13)7-11/h10-14,16H,3-9H2,1-2H3.
What are the key properties of N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide?
N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide has a molecular weight of 250.39 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide is sourced from PubChem (CID 79384307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).