N-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide

C15H26N2O — CID 63715010

IUPACN-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide
SMILESCC1CNCC1C(=O)N(C)CC1CC2CCC1C2
InChIInChI=1S/C15H26N2O/c1-10-7-16-8-14(10)15(18)17(2)9-13-6-11-3-4-12(13)5-11/h10-14,16H,3-9H2,1-2H3
InChIKeyAXOYAMWGYPOLPU-UHFFFAOYSA-N
MW250.39 g/mol
LogP1.74
Rot. Bonds3

About N-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide

N-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide (PubChem CID 63715010) 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,4-dimethylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide
PubChem CID63715010
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide
SMILESCC1CNCC1C(=O)N(C)CC1CC2CCC1C2
InChIInChI=1S/C15H26N2O/c1-10-7-16-8-14(10)15(18)17(2)9-13-6-11-3-4-12(13)5-11/h10-14,16H,3-9H2,1-2H3
InChIKeyAXOYAMWGYPOLPU-UHFFFAOYSA-N
XLogP1.74
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 ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylpyrrolidine-3-carboxamide
CID 79384307
4-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2-dimethylcyclohexane-1-carboxamide
CID 63684313
3-[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]-3-oxopropanoic acid
CID 63685758
(3R,4R)-N,N,4-trimethylpyrrolidine-3-carboxamide
CID 66936245
(2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide
CID 107569736
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methoxy-N,2-dimethylpropanamide
CID 103029139
2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylbutanamide
CID 63683674
N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide
CID 79199997
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-bromo-N-methylbutanamide
CID 63681740
1-(2-bicyclo[2.2.1]heptanylmethyl)-3-cyclobutyl-1-methylurea
CID 116656057
N-[2-bicyclo[2.2.1]heptanylmethyl(methyl)carbamoyl]-3-chloropropanamide
CID 55233841
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylacetamide
CID 79611059

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide (CID 63715010) is N-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide is CC1CNCC1C(=O)N(C)CC1CC2CCC1C2.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide?
The InChIKey is AXOYAMWGYPOLPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-10-7-16-8-14(10)15(18)17(2)9-13-6-11-3-4-12(13)5-11/h10-14,16H,3-9H2,1-2H3.
What are the key properties of N-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide?
N-(2-bicyclo[2.2.1]heptanylmethyl)-N,4-dimethylpyrrolidine-3-carboxamide has a molecular weight of 250.39 g/mol, XLogP of 1.74, 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,4-dimethylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63715010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).